A0A3B3VHB5_9TELE Loading...

Homeobox protein aristaless-like 4

AlphaFold DB , UniProt , Accession A0A3B3VHB5, Species 9TELE (Poecilia latipinna, sailfin molly), Gene n/a, Length 373 aa.

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Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M42.4Very low46.4Very low247 Ų247143.6 Ų143.6100%1.21781%0.808SS**  0110.40-68.9165.8165.800106.4
2N39.3Very low46.3Very low168 Ų168145.2 Ų145.290%0.89881%0.807SS**  trans-66.6147.7178.2-61.6-31.3000110.4
3A41.2Very low46.6Very low100 Ų100143.9 Ų143.983%0.82681%0.806SS**  trans-165.5117.1137.200000109.6
4E50.2Low47Very low176 Ų176140 Ų14082%0.82279%0.793SS**  trans-67.9153.7170.7-58.7170.3117.100110.3
5T53.4Low47.3Very low145 Ų145143.1 Ų143.189%0.8980%0.801SS**  trans-140.3110.9154.5-40.90000108.9
6C44.1Very low46.9Very low96 Ų96144.2 Ų144.265%0.64981%0.805SS**  trans-76.8137.9177.9-68.50000112.1
7V44.2Very low46.6Very low131 Ų131142.1 Ų142.179%0.79480%0.802SS**  66.8149.9126.7179.70000117.1
8P56.1Low46.5Very low107 Ų107147 Ų14770%0.69581%0.808SS**  cis-134.4164.117.71611.5000119.1
9Y48.7Very low46.3Very low197 Ų197151.8 Ų151.877%0.77382%0.815SS**  trans-41129.2149-171.8-93.8000113.6D11Y9-D11 HydrophobicContact CE1-CB 4.32Å
10S46.1Very low46.1Very low112 Ų112150.2 Ų150.278%0.78382%0.815SS**  trans-150108.3155.7-72.10000109.9
11D44.4Very low46.3Very low101 Ų101149.2 Ų149.254%0.5482%0.817SS.*  trans-53.6127.8160.1-163-31000110.2Y9 T13Y9-D11 HydrophobicContact CE1-CB 4.32Å; D11-T13 PolarHBondContact OD1-N 3.04Å; D11-T13 PolarHBondContact OD1-OG1 3.39Å
12M45.7Very low46Very low162 Ų162143 Ų14380%0.79880%0.797SS**  trans-140.672.3160.2-98.4-155.772.800109.1S14M12-S14 VanDerWaalsContact C-N 3.26Å; M12-S14 PolarHBondContact O-N 3.39Å
13T50.5Low46.1Very low129 Ų129139.6 Ų139.679%0.79179%0.793SS**  trans-55.688.5153.4-50.10000109.4D11D11-T13 PolarHBondContact OD1-N 3.04Å; D11-T13 PolarHBondContact OD1-OG1 3.39Å
14S52.5Low45.9Very low89 Ų89138.9 Ų138.962%0.62279%0.787SS**  trans-167.383.6170.3-171.50000111.6M12M12-S14 VanDerWaalsContact C-N 3.26Å; M12-S14 PolarHBondContact O-N 3.39Å
15M50.2Low45.4Very low186 Ų186140 Ų14092%0.91679%0.792SS**  trans-165.746.1150.2-130.6162.773.900113.9
16D41.8Very low44.4Very low161 Ų161136.8 Ų136.886%0.86179%0.788SS**  trans-136.777.8166.7-137.1-65.9000109.7
17S42.2Very low44.1Very low109 Ų109143.2 Ų143.276%0.76280%0.799SS**  trans-154.358177.6-65.60000110.2
18Y44.5Very low43.7Very low230 Ų230142.6 Ų142.690%0.90279%0.791SS**  trans-150.173.7164-89.6-78.9000109.4
19Y42.8Very low43Very low239 Ų239145.3 Ų145.394%0.93779%0.794SS**SBendtrans-178.679.5143.9-110.2-79000109.5
20S41.4Very low42.4Very low119 Ų119144.2 Ų144.283%0.83280%0.796SS**  trans-171.5121.4152.7-88.50000110.6
21P50.1Low41.8Very low129 Ų129142.7 Ų142.784%0.83879%0.79SS**  trans-91121.2161.1811.2000110.5
22S37.4Very low41.5Very low116 Ų116144 Ų14481%0.81180%0.797SS**  trans-48.4130.3161.6-70.40000111.9
23A40.7Very low41.1Very low97 Ų97143 Ų14380%0.80279%0.79SS**  62.8117.486.500000115.3
24A37.6Very low40.2Very low85 Ų85145.1 Ų145.170%0.70279%0.789SS**  175.7129.3123.700000113.5
25Q38.2Very low39.6Very low199 Ų199150.5 Ų150.593%0.9380%0.795SS**  trans54.1135137.2-71.8169.1-72.400122.2
26G33.5Very low39.1Very low79 Ų79147.5 Ų147.581%0.81479%0.788SS**  trans151103.3139.800000117
27R37.4Very low38.9Very low231 Ų231148.3 Ų148.387%0.87278%0.784SS**  trans-35.5152.8163.2-95.2174.1176165.1-1.2119.4
28D36.9Very low39.5Very low117 Ų117148.5 Ų148.563%0.62678%0.783SS**  trans78.8122.3136.2-69.7-45.5000123
29H40.7Very low39.1Very low164 Ų164142.3 Ų142.376%0.75978%0.779SS**  trans64.2122.5135.5-71.7-59.7000123.8
30Q35Very low39.3Very low175 Ų175136.7 Ų136.782%0.81878%0.775SS**  87.9124.3121.9-170.4169.91900120.6
31A34.4Very low39.2Very low79 Ų79137.7 Ų137.765%0.65377%0.771SS**  trans63.2147.714900000117.4
32D37.5Very low38.9Very low129 Ų129139.2 Ų139.269%0.6977%0.77SS**  cis-169.4157.72.8-116-37.6000107.4
33H36.9Very low39.2Very low140 Ų140141.4 Ų141.465%0.64877%0.765SS**  trans57.1113.5144.8-69.154.7000120.3
34F31.9Very low39.2Very low175 Ų175147.3 Ų147.377%0.76877%0.768SS**  178.4130.298.5-101.6-78.8000113.1
35R40.3Very low39Very low202 Ų202148.5 Ų148.576%0.76277%0.771SS**  trans79.283.2152.7-79161.1-164-94.63.8120.8
36T39.8Very low39Very low123 Ų123144.7 Ų144.776%0.75577%0.766SS**  trans-67.1155.7133.8-51.10000111.9
37F37.5Very low39.1Very low177 Ų177147.5 Ų147.578%0.77677%0.768SS**  trans-171.9157.8137.9-84.6-60.8000109.7
38P55.4Low39.5Very low114 Ų114140.6 Ų140.674%0.7476%0.761SS**  -130.9159.1-55.226.4-6.4000113.3
39A35.9Very low39.3Very low100 Ų100144 Ų14483%0.82677%0.77SS**PPolyproline II helixtrans-98.1140157.500000108.9
40S46.2Very low39.2Very low121 Ų121143.1 Ų143.185%0.84677%0.77SS**PPolyproline II helixtrans-77.5136.8-179.336.90000113.1
41D38.8Very low39.2Very low140 Ų140140.3 Ų140.375%0.74977%0.77SS**PPolyproline II helixtrans-50.3153176.1-71.7-75.8000116.1
42I44.2Very low39.2Very low160 Ų160142 Ų14282%0.82178%0.777SS**  -164.1100.4121.4-84.5141.2000110.2
43K43.8Very low39.2Very low163 Ų163146.2 Ų146.271%0.70979%0.789SS**  trans32.8115.2131.9-45.8176-173176.70120.9
44Y40.2Very low39.1Very low220 Ų220142.7 Ų142.786%0.86379%0.791SS**  169.3143.298.4-106.9-85.5000112.3
45S33.9Very low39.2Very low111 Ų111144 Ų14478%0.77680%0.799SS**  trans-72.8150.2-154.2-52.30000119.9
46S38Very low39Very low118 Ų118138.2 Ų138.283%0.82580%0.795SS**  trans-70.4144.9150.6-780000112.2
47T36Very low38.6Very low138 Ų138143.5 Ų143.585%0.84780%0.803SS**  trans-148.2129.5145.333.60000110.4
48A45.3Very low38.5Very low87 Ų87138.7 Ų138.772%0.71980%0.803SS**  trans-86.2150.3169.100000110
49F33.4Very low37.7Very low188 Ų188141.5 Ų141.583%0.82581%0.806SS**  trans-164.5123.6149.5-99.3-66.3000113
50L39.5Very low37.6Very low146 Ų146146.4 Ų146.476%0.76481%0.809SS**  trans39.6125.3141.4-68.3165.1000121.9
51S33.8Very low37.4Very low116 Ų116145.9 Ų145.981%0.81181%0.805SS**  161.2149.2100.7-94.40000115
52S35.3Very low37.1Very low115 Ų115150.7 Ų150.780%0.80481%0.812SS**  trans-68.4150.9-170.6-48.50000118.3
53K36Very low36.8Very low216 Ų216148.4 Ų148.494%0.93981%0.81SS**  trans156.7132.6137-99.6179.9170.2175.80107.4
54G35.2Very low36.9Very low66 Ų66145.8 Ų145.868%0.6881%0.81SS**  cis154130.68.500000106.7
55Q34.8Very low36.5Very low202 Ų202144.4 Ų144.494%0.94481%0.809SS**  trans59.2155.1159.5-67.6-175.4-26.400119.1
56A35.6Very low36.4Very low81 Ų81146.9 Ų146.967%0.66981%0.808SS**  cis-177145.5-22.600000106
57Y32.2Very low36.2Very low235 Ų235148.4 Ų148.492%0.92280%0.802SS**  trans49.2127.9147.6-91.5-97.1000122.2
58G34.3Very low36Very low75 Ų75149 Ų14977%0.77380%0.795SS**  trans175.361.3162.900000115.6
59E40Very low35.4Very low174 Ų174151.5 Ų151.581%0.81381%0.806SS**  trans-66.2129.9160.5-168.3-175.2163.200109.2
60K33.7Very low35.5Very low203 Ų203151.5 Ų151.588%0.88381%0.809SS**  trans-172.7129.5152.2-85.5129.4-164.1-166.60112.2
61S40.7Very low35.1Very low109 Ų109148.9 Ų148.976%0.76280%0.802SS**  trans-60.6146.3167.4-35.30000114.1
62R33.9Very low35.2Very low242 Ų242151.3 Ų151.391%0.91381%0.805SS**  trans149.5123.9132.6-87.9-180175.9-167.6-1.1113.1
63S37.6Very low35.1Very low111 Ų111152.4 Ų152.478%0.77680%0.802SS**  trans-66.7146.2141.7172.80000107.9
64P46.3Very low35.2Very low108 Ų108145.8 Ų145.870%0.70179%0.788SS**  -154.7157.158.440.1-17.6000119.5
65F30.2Very low35.1Very low192 Ų192147.6 Ų147.684%0.84280%0.796SS**  trans61.1143.9145.6-128.2-110.3000122.9
66Q32.3Very low35.1Very low163 Ų163142.5 Ų142.576%0.76279%0.789SS**  trans74.9139.9172.7-51.3-168.9-72.200114.9
67Q34Very low35.4Very low150 Ų150143.7 Ų143.770%0.70180%0.799SS**  cis-166.9146.430.4-142170.5-46.100102.8
68E32.1Very low35.5Very low150 Ų150136.3 Ų136.370%0.70180%0.795SS**  154.7129.964.8-176140.294.800104.5
69C31.8Very low35.7Very low139 Ų139142.6 Ų142.694%0.93980%0.804SS**  trans-167.686.8156.7-95.40000108.6
70Q35.2Very low35.6Very low188 Ų188137.7 Ų137.788%0.87980%0.8SS**  trans-84.9153.9145.8-78.4178.128.400106.4
71S32.2Very low35.9Very low91 Ų91133.9 Ų133.964%0.63680%0.799SS**  cis-171.7149.70.71710000104.9
72L36.6Very low35.6Very low167 Ų167138.4 Ų138.487%0.87481%0.805SS**  trans-159.2113.6134.6-95.9176.5000108.4
73D31.9Very low36.1Very low138 Ų138132 Ų13274%0.73880%0.797SS**  trans3.3149.8157-76.9-86.7000121.1
74A37.6Very low36.6Very low78 Ų78135 Ų13565%0.64580%0.797SS**  cis-173151-2.700000110.3
75A34.3Very low36.6Very low103 Ų103140.6 Ų140.685%0.85181%0.805SS**  trans58.2131.1148.300000119.3
76A35.6Very low37.5Very low95 Ų95140.2 Ų140.279%0.78581%0.806SS**  cis-162.6153.322.500000112.1
77A39.8Very low38.3Very low106 Ų106140.2 Ų140.288%0.87681%0.81SS**  trans70.4113.8149.100000121
78G35.8Very low38.9Very low81 Ų81142.9 Ų142.984%0.83582%0.82SS**  105.793.7125.700000117.8
79Q38.7Very low39.6Very low206 Ų206144.4 Ų144.496%0.96383%0.829SS**  trans-50.4152.2159.1-56-179-2.400111.3
80G36.6Very low40.1Very low72 Ų72146.8 Ų146.874%0.74283%0.826SS**  cis175.4177.47.600000111.3
81S39.7Very low40.3Very low122 Ų122149.7 Ų149.785%0.85383%0.829SS**  trans70.797.8164.7-148.30000119.1S83S81-S83 PolarHBondContact O-N 2.98Å
82F36.2Very low40.4Very low204 Ų204151.1 Ų151.190%0.89584%0.839SS**  trans-68.6109.9172.1-133.5-100.9000110.9K84F82-K84 PolarHBondContact O-N 3.23Å
83S42.7Very low40.6Very low107 Ų107148.7 Ų148.775%0.74884%0.836SS**  trans-81.297.1167.7-78.50000110.7S81 Y85S81-S83 PolarHBondContact O-N 2.98Å; S83-Y85 PolarHBondContact O-N 3.35Å
84K49Very low40.7Very low176 Ų176148 Ų14877%0.76584%0.84SS**THydrogen-bonded Turntrans-78.552.7178.2-166.7-173.7177.4171.30112.8F82F82-K84 PolarHBondContact O-N 3.23Å
85Y46.3Very low40.8Very low224 Ų224154.2 Ų154.288%0.87885%0.853SS**THydrogen-bonded Turntrans-145.416.4177.6-62.9-72.6000116.5S83S83-Y85 PolarHBondContact O-N 3.35Å
86H49.2Very low41.5Very low184 Ų184155.3 Ų155.385%0.85285%0.849SS**  trans-118.440-175-144.7-76.4000115.8
87L49.5Very low42.2Very low164 Ų164156.4 Ų156.486%0.85985%0.848SS**  trans-13640.3180-147.577.1000116.4
88F46.5Very low42.6Very low205 Ų205157.7 Ų157.790%0.89985%0.848SS**SBendtrans-14134.2170.8-125.2-85000116.2
89M47.2Very low43Very low183 Ų183158.1 Ų158.190%0.90184%0.843SS**  trans-14158.7167.3-76.8-66.8-82.300111.4
90H41.9Very low43.1Very low189 Ų189155.4 Ų155.488%0.87584%0.835SS**  trans-126.9103.6160.3-116.7-90.6000109.3
91R39.3Very low43.2Very low248 Ų248159.3 Ų159.394%0.93684%0.839SS**PPolyproline II helixtrans-63.3127.2170.9-84170.4124-161.7-0.7109.1S93R91-S93 PolarHBondContact O-N 3.05Å
92S34.9Very low43.4Very low121 Ų121162.2 Ų162.285%0.84684%0.836SS**PPolyproline II helixtrans-67.7121168.9-400000109.7
93S40.4Very low43.4Very low117 Ų117159.7 Ų159.782%0.81883%0.831SS**PPolyproline II helixtrans-65.1145.2169.7-164.70000110.6R91R91-S93 PolarHBondContact O-N 3.05Å
94C33.6Very low43Very low122 Ų122162.1 Ų162.182%0.82484%0.835SS**PPolyproline II helixtrans-56.3135.1-177.9-55.10000111.8
95K39.7Very low42.8Very low210 Ų210158.8 Ų158.891%0.91383%0.832SS**  trans-89.9109.4179.6-163.6141.8178.3172.40109.3
96T48.8Very low42.1Very low125 Ų125154.8 Ų154.877%0.76782%0.821SS**PPolyproline II helixtrans-81.8142.5163.942.20000109.5
97P51.2Low41.4Very low118 Ų118155.4 Ų155.477%0.76682%0.816SS**PPolyproline II helixtrans-82.5148.4174.131.8-30.2000110.9
98P47.3Very low40.6Very low134 Ų134150.3 Ų150.387%0.8780%0.803SS**PPolyproline II helixtrans-81.7133.6175.533.1-29.5000109.9
99A43.5Very low40.4Very low89 Ų89147.4 Ų147.474%0.73679%0.792SS**  trans-107.1123.8161.900000107.1
100D40.7Very low40Very low149 Ų149146.3 Ų146.380%0.79779%0.79SS**  trans-173.7118.5147.2-103.9-52.9000109.1
101D38.8Very low39.8Very low154 Ų154141.1 Ų141.182%0.82479%0.787SS**  trans-152.4115.8133.4-143.3-67.8000108.5
102K45.6Very low39.8Very low183 Ų183133.8 Ų133.880%0.79678%0.78SS**  trans-123.7120.4177.6-96.2-178.7178-81.10107.6
103L35.8Very low40.1Very low151 Ų151136.1 Ų136.179%0.79178%0.782SS**  trans-152.1125.4154.7-71.3-178.2000104.3
104L33Very low40.3Very low159 Ų159135.4 Ų135.483%0.83277%0.772SS**  cis-169.4-179.343.5-104.6153.9000107.8
105P45.7Very low40.6Very low106 Ų106135.6 Ų135.669%0.68877%0.772SS**  trans-122.2-156.6-143.540.6-19.8000113.2
106E31.8Very low40.3Very low139 Ų139129.5 Ų129.565%0.6576%0.755SS**  trans91.6102.7173.5-74.4-85.3108.700115.1
107R33.1Very low39.7Very low197 Ų197134 Ų13474%0.74376%0.759SS**  85.3121.292-179.4-172.7-74.7-103.8-0.5110.2
108G34.3Very low38.9Very low57 Ų57131.9 Ų131.959%0.58876%0.759SS**  cis175.6-175.60.800000108.9
109H40.8Very low38.4Very low145 Ų145134.6 Ų134.667%0.67176%0.757SS**  trans86.7107.9156.7-4190.3000119
110N40.1Very low38Very low160 Ų160136 Ų13686%0.85675%0.752SS**  trans61.9125.9131.9-48.3-31.5000120.7
111G37.7Very low38.1Very low79 Ų79133.6 Ų133.681%0.81475%0.747SS**  trans156.793.8155.300000113.9
112A38.9Very low38.4Very low95 Ų95132.2 Ų132.279%0.78575%0.749SS**  trans-57.1148.3178.500000114.1
113L40.5Very low37.9Very low170 Ų170127 Ų12789%0.8975%0.747SS**  trans-158.893.6141.8-105.8157000109.6
114V45.6Very low38.2Very low101 Ų101127.3 Ų127.361%0.61275%0.749SS**  trans-67.5142.4151.1173.80000106.8C116V114-C116 HydrophobicContact CG1-CB 4.2Å; V114-C116 WeakPolarHBondContact CG1-SG 3.24Å
115P38.9Very low38.5Very low127 Ų127125.7 Ų125.783%0.82575%0.746SS**  -123.7140.8103.9-1030.1000116.5
116C34.1Very low37.8Very low82 Ų82127.5 Ų127.555%0.55475%0.749SS**  trans-83.3159179.5-72.20000114.1V114V114-C116 HydrophobicContact CG1-CB 4.2Å; V114-C116 WeakPolarHBondContact CG1-SG 3.24Å
117Y35.6Very low38.4Very low219 Ų219125.1 Ų125.186%0.85975%0.748SS**  trans-27.6158.4154-16.8-85.5000118.3
118G34.6Very low38.5Very low73 Ų73122.3 Ų122.375%0.75375%0.748SS**  trans106.3117.214700000114.1
119K36.7Very low38.8Very low191 Ų191127.2 Ų127.283%0.8376%0.76SS**  84.6100.559.1-173.2141-178.5173.50112.7
120D36.7Very low38.8Very low120 Ų120124.7 Ų124.764%0.64276%0.764SS**  trans70.413514386.6-113.4000124.8
121S41.1Very low39.4Very low97 Ų97122.5 Ų122.568%0.67876%0.759SS**  trans85.288.3142.3-43.80000122.9
122S45.3Very low39.2Very low126 Ų126125.9 Ų125.988%0.88176%0.758SS**  48.5126.8126.262.40000124.7
123G35.9Very low39.3Very low72 Ų72125.8 Ų125.874%0.74275%0.752SS**  trans161.5125.3142.900000118.5
124L42.3Very low39.5Very low159 Ų159125.2 Ų125.283%0.83275%0.75SS**  trans98.696.1153.3-52177.2000119.7
125T39.3Very low39.8Very low125 Ų125126.1 Ų126.177%0.76776%0.758SS**  73127.4105.567.70000114.4
126D31.8Very low40.5Very low143 Ų143125.8 Ų125.877%0.76576%0.755SS**  -175.3140.550.5-178.7-105.9000110.7
127S43.5Very low40.9Very low89 Ų89125.1 Ų125.162%0.62276%0.762SS**  trans54.6138.2153.8-48.90000121.1
128D35.9Very low41.2Very low139 Ų139123.3 Ų123.374%0.74376%0.764SS**  cis-169.3157.314.4-138.8-49.2000111.1
129L38.8Very low41.5Very low160 Ų160125.1 Ų125.184%0.83876%0.756SS**  trans82.5108163.1-53177.1000122.5
130A41.1Very low42Very low92 Ų92121.9 Ų121.976%0.7676%0.758SS**  trans-89.2-177.4157.300000110.3
131P54.1Low42.5Very low114 Ų114126.3 Ų126.374%0.7477%0.766SS**  cis-148.8172.445.941.3-19.4000118.5
132D33.6Very low42.2Very low149 Ų149131.9 Ų131.980%0.79777%0.773SS**  trans66.1135.2144.6-109.2-113.3000119.8
133S39.8Very low41.8Very low94 Ų94133.7 Ų133.766%0.65777%0.772SS**  cis-158.4156.313.6-360000109.2
134D44.1Very low42Very low158 Ų158135 Ų13585%0.84578%0.776SS**  trans-55.6161.5168.7-69.7-67.9000114
135P53.4Low41.6Very low120 Ų120134 Ų13478%0.77978%0.776SS**  trans-121.4135.613634.2-26.8000112.6
136P52Low41.6Very low120 Ų120137.8 Ų137.878%0.77978%0.782SS**  trans-80.5165.917634.2-33.1000112
137G43Very low41.8Very low68 Ų68137.6 Ų137.670%0.70178%0.781SS**  trans-50.7142.7-179.400000114.6
138M42Very low41.3Very low180 Ų180142 Ų14289%0.88779%0.792SS**  trans-10698.5175.6-16175.4174.900109.1
139D40.8Very low41.3Very low111 Ų111138 Ų13859%0.59478%0.783SS**  trans-68.9148165.933.7-79.1000112.7R141D139-R141 PolarHBondContact O-N 2.92Å
140S48.4Very low41.3Very low124 Ų124137.9 Ų137.987%0.86779%0.788SS**  trans-63.291.2-175.2-177.30000112.8
141R46.1Very low41.1Very low213 Ų213143.3 Ų143.380%0.80480%0.795SS**  trans-143.593.3163.5-90.3-172.1-85-154.5-4112.7D139D139-R141 PolarHBondContact O-N 2.92Å
142Y34.2Very low40.1Very low214 Ų214142.9 Ų142.984%0.83980%0.801SS**  trans-137.9113157.5-107.1-99.7000103.2
143L38.9Very low40.2Very low164 Ų164140.7 Ų140.786%0.85980%0.804SS**  -16211567.5-73.7162000109.4
144A38.9Very low40Very low99 Ų99141.6 Ų141.682%0.81881%0.81SS**  trans-161125.7150.200000109.9
145V34.3Very low39.6Very low137 Ų137142.8 Ų142.883%0.8381%0.81SS**  trans138108.7148.9170.80000110
146K38.2Very low39Very low206 Ų206149 Ų14990%0.89682%0.818SS**  trans-120.6104.1152.3-175.6163.9-178.3172.60105.9
147D36Very low38.4Very low138 Ų138148.2 Ų148.274%0.73882%0.816SS**  trans-98.1135.5162.8-175.1-87.8000108.1
148Q34.6Very low38.9Very low183 Ų183150.3 Ų150.386%0.85582%0.817SS**  trans-153.7103.8149.6-166129.558.300108.3
149G34.4Very low38.7Very low54 Ų54146.9 Ų146.956%0.55781%0.811SS**  trans-85.2156.317100000114.1
150V39Very low38.6Very low157 Ų157147.7 Ų147.795%0.95282%0.815SS**  trans-149.4139.4141.8-129.30000110.2
151K38.2Very low38.1Very low207 Ų207147.8 Ų147.890%0.981%0.806SS**  trans-75.1152.4-169.7-66.4176.4170.6175.70114.8
152A31.5Very low38.1Very low105 Ų105145.7 Ų145.787%0.86881%0.81SS**  -178140.511500000114.2
153A36.4Very low38.4Very low103 Ų103140.3 Ų140.385%0.85181%0.809SS**  trans-23.1143.8174.700000122.1
154S36.6Very low38.5Very low113 Ų113138 Ų13879%0.7981%0.807SS**  174.9119.6112.4-172.80000112.6
155E35.1Very low39.5Very low182 Ų182138.7 Ų138.785%0.8580%0.803SS**  trans25.4117.6142.3-59.4-74.8123.600120.4
156R40Very low39.9Very low250 Ų250139.9 Ų139.994%0.94380%0.804SS**  168.7121.6122.6-176.4172.1-105.1-169.7-5.6111.4
157S40.1Very low40.3Very low104 Ų104137.7 Ų137.773%0.72780%0.797SS**  trans-76.9-175.4173.1-132.70000111.7
158P53.3Low40.8Very low112 Ų112140.9 Ų140.973%0.72780%0.804SS**  -128.2167.9-56.330.3-11.6000111.4
159S37.4Very low41.5Very low109 Ų109139 Ų13976%0.76281%0.805SS**  trans-169.2127.7146.9-119.10000114.4
160N38.2Very low41.8Very low128 Ų128144.1 Ų144.168%0.68482%0.82SS**  trans75.2111.9141.7-79.643.4000122.7
161D39.8Very low42.3Very low125 Ų125140 Ų14067%0.66881%0.808SS**  88.995.9130-57.6-40.3000120.6
162L44.9Very low42.7Very low169 Ų169133.7 Ų133.789%0.88580%0.802SS**  6.7120.5125.6-81.3117.5000117.4
163A40.5Very low43.6Very low101 Ų101136.8 Ų136.884%0.83580%0.799SS**  -176.6126106.800000110.9
164S42.1Very low44.4Very low117 Ų117137.5 Ų137.582%0.81880%0.798SS**  trans-107.1-178166.9-143.60000108.6
165P58.8Low45.1Very low112 Ų112139.5 Ų139.573%0.72780%0.8SS**  -116.2145.3-116.529.1-8.1000112.5
166L43.7Very low46.1Very low162 Ų162140 Ų14085%0.84880%0.799SS**  trans-154.8111.5162.4-151.369.3000112.9
167E46.3Very low46.9Very low161 Ų161130.3 Ų130.375%0.75278%0.777SS**  trans35.8120.3132.3-45.8-92.2120.200118.3
168K46.3Very low48.2Very low205 Ų205135.4 Ų135.489%0.89179%0.786SS**  -178.9130.1107.1-97.5171.5-179-173.80112.9
169V49.4Very low49Very low143 Ų143139.2 Ų139.287%0.86779%0.792SS**  trans-44.1130.9161.8166.90000112.2
170D40.9Very low51.1Low162 Ų162144.6 Ų144.687%0.86680%0.795SS**  trans-152.6145.1135.1-165.5-132.9000111.3
171G48.9Very low53.1Low69 Ų69149.8 Ų149.871%0.71181%0.805SS**  trans-65.7135.7-158.100000116.5
172G45.7Very low55.2Low75 Ų75150.7 Ų150.777%0.77381%0.81SS**  trans-13927172.100000113.5
173E51.5Low57.4Low170 Ų170153 Ų15379%0.79481%0.807SS**  trans-114.477.1-178.2-68.7-167.489.500112.1
174S53.5Low59.8Low119 Ų119150.5 Ų150.583%0.83278%0.781SS**  trans-163.641.7155.7-84.20000113.3
175N50.9Low62.3Low155 Ų155150.9 Ų150.983%0.82978%0.779SS**  trans-133.360.3160.1-131.7-64000110.7G177N175-G177 PolarHBondContact O-N 3.16Å
176K55.5Low64.1Low191 Ų191148.5 Ų148.583%0.8376%0.757SS**  trans-70.567.8158.9-77169.1177.6161.20107.9K178K176-K178 PolarHBondContact O-N 3.37Å
177G57.5Low66.7Low48 Ų48144.4 Ų144.450%0.49574%0.739SS.*  trans-51.5127.2170.800000108.2N175 K179N175-G177 PolarHBondContact O-N 3.16Å; G177-K179 PolarHBondContact O-N 3.03Å
178K66.7Low69.2Low210 Ų210140.6 Ų140.691%0.91373%0.73SS**  trans-49.999.7178.5-80137.7176.2166.40109K176 R180K176-K178 PolarHBondContact O-N 3.37Å; K178-R180 PolarHBondContact O-N 3.46Å
179K71Confident71.6Confident193 Ų193136.8 Ų136.884%0.83971%0.711SS**  trans-62.4108.6179.1-165.7155-178.4171.20106.7G177 R181G177-K179 PolarHBondContact O-N 3.03Å; K179-R181 PolarHBondContact O-N 3.48Å
180R80.1Confident74Confident222 Ų222131.1 Ų131.184%0.83868%0.675SS**  trans-52.9126.5-178.9-134.5173.683.4-156.85.6107.3K178 N182K178-R180 PolarHBondContact O-N 3.46Å; R180-N182 PolarHBondContact O-N 3.16Å
181R81.4Confident76.7Confident236 Ų236126.7 Ų126.789%0.89165%0.651SS**  trans-50.3128.8178.8-90.3-177.4-98.3163-7.2109.4K179 R183K179-R181 PolarHBondContact O-N 3.48Å; R181-R183 PolarHBondContact O-N 3.36Å; R181-R183 VanDerWaalsContact O-N 3.08Å
182N83.5Confident79.1Confident144 Ų144128.9 Ų128.977%0.7764%0.643SS**  trans-56.4115.3-179.8-49.943.2000107.8R180R180-N182 PolarHBondContact O-N 3.16Å
183R90.8Very high81.6Confident218 Ų218126.9 Ų126.982%0.82361%0.613SS**PPolyproline II helixtrans-81.2129.3179.4-170.9179.6-171.8177.63.8108.3R181 T185R181-R183 PolarHBondContact O-N 3.36Å; R181-R183 VanDerWaalsContact O-N 3.08Å; R183-T185 PolarHBondContact O-N 2.95Å
184T90.6Very high83.8Confident49 Ų49118.8 Ų118.830%0.30158%0.576SS.*PPolyproline II helixtrans-66.5127.2172.1-46.80000109.7F186 L218 R222T184-F186 HydrophobicContact CG2-CD1 4.45Å; T184-F186 HydrophobicContact CG2-CE1 4.06Å; T184-F186 HydrophobicContact CG2-CZ 4.34Å; T184-L218 HydrophobicContact CG2-CD2 4.5Å; T184-R222 WeakPolarHBondContact OG1-CD 3.34Å; T184-R222 PolarHBondContact OG1-NH1 3.5Å
185T94.7Very high86Confident124 Ų124115.2 Ų115.276%0.76155%0.546SS*.PPolyproline II helixtrans-102.5127.9168.548.80000108.4R183R183-T185 PolarHBondContact O-N 2.95Å
186F97.4Very high88.2Confident63 Ų63112.4 Ų112.428%0.27653%0.526SS..PPolyproline II helixtrans-90.4140.9-179.9-58.7-74.2000110.3T184 Q190 L191 L218 W226T184-F186 HydrophobicContact CG2-CD1 4.45Å; T184-F186 HydrophobicContact CG2-CE1 4.06Å; T184-F186 HydrophobicContact CG2-CZ 4.34Å; F186-Q190 VanDerWaalsContact CA-OE1 3.3Å; F186-Q190 HydrophobicContact CB-CB 4.45Å; F186-L191 HydrophobicContact CB-CD1 4.43Å; F186-L191 HydrophobicContact CB-CD2 3.7Å; F186-L191 HydrophobicContact CB-CG 3.83Å; F186-L191 HydrophobicContact CD2-CD2 4.27Å; F186-L191 HydrophobicContact CG-CD2 4.15Å; F186-L218 HydrophobicContact CD1-CD1 3.72Å; F186-L218 HydrophobicContact CD1-CD2 4.13Å; F186-L218 HydrophobicContact CE1-CD1 3.62Å; F186-L218 HydrophobicContact CE1-CD2 4.05Å; F186-L218 HydrophobicContact CE1-CG 4.5Å; F186-W226 AromaticContact CD2-CD1 3.87Å; F186-W226 AromaticContact CE2-CD1 3.59Å; F186-W226 HydrophobicContact CZ-CB 4.33Å; F186-W226 AromaticContact CZ-CD1 3.87Å
187T98.4Very high90.3Very high75 Ų75104.8 Ų104.846%0.4650%0.495SS..PPolyproline II helixtrans-75.7166.1171.670.90000110.7Y189 Q190 L191T187-Y189 PolarHBondContact O-N 3.13Å; T187-Q190 PolarHBondContact O-N 2.87Å; T187-Q190 VanDerWaalsContact OG1-CG 3.26Å; T187-Q190 WeakPolarHBondContact OG1-CG 3.38Å; T187-Q190 PolarHBondContact OG1-N 2.77Å; T187-L191 WeakPolarHBondContact O-CG 3.35Å; T187-L191 PolarHBondContact O-N 3.34Å; T187-L191 VanDerWaalsContact O-N 3.14Å
188S97.9Very high92.2Very high82 Ų82102.7 Ų102.757%0.57347%0.473SS*.Hα-helixtrans-58-49.5177.3-162.90000111.5Q190 L191 E192S188-Q190 VanDerWaalsContact C-N 3.31Å; S188-Q190 PolarHBondContact O-N 2.87Å; S188-L191 WeakPolarHBondContact O-CB 3.49Å; S188-L191 PolarHBondContact O-N 2.94Å; S188-E192 WeakPolarHBondContact O-CG 3.47Å; S188-E192 PolarHBondContact O-N 3.46Å; S188-E192 PolarHBondContact OG-OE1 3.22Å
189Y98.3Very high93.7Very high124 Ų12499.8 Ų99.849%0.48646%0.462SS..Hα-helixtrans-53.8-45.3178.2174.4-102.9000112.9T187 L191 E192 E193T187-Y189 PolarHBondContact O-N 3.13Å; Y189-L191 VanDerWaalsContact C-N 3.34Å; Y189-L191 PolarHBondContact O-N 3.01Å; Y189-E192 PolarHBondContact O-N 3.45Å; Y189-E193 HydrophobicContact CE2-CG 4.17Å; Y189-E193 PolarHBondContact O-N 3.1Å; Y189-E193 VanDerWaalsContact O-N 3.11Å
190Q98.3Very high95Very high24 Ų2498.4 Ų98.411%0.11246%0.456CS..Hα-helixtrans-62.2-43.3177.8-68.9173.3-2300111.4F186 T187 S188 E192 L194 T216 L218F186-Q190 VanDerWaalsContact CA-OE1 3.3Å; F186-Q190 HydrophobicContact CB-CB 4.45Å; T187-Q190 PolarHBondContact O-N 2.87Å; T187-Q190 VanDerWaalsContact OG1-CG 3.26Å; T187-Q190 WeakPolarHBondContact OG1-CG 3.38Å; T187-Q190 PolarHBondContact OG1-N 2.77Å; S188-Q190 VanDerWaalsContact C-N 3.31Å; S188-Q190 PolarHBondContact O-N 2.87Å; Q190-E192 VanDerWaalsContact C-N 3.34Å; Q190-L194 WeakPolarHBondContact O-CB 3.42Å; Q190-L194 WeakPolarHBondContact O-CD1 3.28Å; Q190-L194 WeakPolarHBondContact O-CG 3.41Å; Q190-L194 PolarHBondContact O-N 2.8Å; Q190-L194 VanDerWaalsContact O-N 3.08Å; Q190-T216 WeakPolarHBondContact CG-O 3.49Å; Q190-T216 PolarHBondContact NE2-O 2.89Å; Q190-L218 HydrophobicContact CB-CD1 4.47Å; Q190-L218 HydrophobicContact CG-CD1 4.47Å
191L98.4Very high95.8Very high70 Ų7090.6 Ų90.637%0.36643%0.433SS..Hα-helixtrans-65.5-38.4178.3-67174.8000112F186 T187 S188 Y189 L194 E195 W226F186-L191 HydrophobicContact CB-CD1 4.43Å; F186-L191 HydrophobicContact CB-CD2 3.7Å; F186-L191 HydrophobicContact CB-CG 3.83Å; F186-L191 HydrophobicContact CD2-CD2 4.27Å; F186-L191 HydrophobicContact CG-CD2 4.15Å; T187-L191 WeakPolarHBondContact O-CG 3.35Å; T187-L191 PolarHBondContact O-N 3.34Å; T187-L191 VanDerWaalsContact O-N 3.14Å; S188-L191 WeakPolarHBondContact O-CB 3.49Å; S188-L191 PolarHBondContact O-N 2.94Å; Y189-L191 VanDerWaalsContact C-N 3.34Å; Y189-L191 PolarHBondContact O-N 3.01Å; L191-L194 PolarHBondContact O-N 3.15Å; L191-E195 VanDerWaalsContact O-CB 3.26Å; L191-E195 WeakPolarHBondContact O-CB 3.43Å; L191-E195 PolarHBondContact O-N 3.08Å; L191-W226 HydrophobicContact CD2-CZ2 4.35Å; L191-W226 VanDerWaalsContact CD2-NE1 3.27Å
192E98.4Very high96.6Very high115 Ų11582.1 Ų82.154%0.53740%0.404SS..Hα-helixtrans-63.2-49.9178.5-73.2162.3-146.300111.8S188 Y189 Q190 L194 E195 K196S188-E192 WeakPolarHBondContact O-CG 3.47Å; S188-E192 PolarHBondContact O-N 3.46Å; S188-E192 PolarHBondContact OG-OE1 3.22Å; Y189-E192 PolarHBondContact O-N 3.45Å; Q190-E192 VanDerWaalsContact C-N 3.34Å; E192-L194 PolarHBondContact O-N 3.29Å; E192-E195 PolarHBondContact O-N 3.18Å; E192-K196 VanDerWaalsContact O-CB 3.27Å; E192-K196 WeakPolarHBondContact O-CB 3.33Å; E192-K196 PolarHBondContact O-N 3.04Å
193E98.4Very high97.3Very high33 Ų3382.6 Ų82.615%0.15440%0.396CS..Hα-helixtrans-65.9-38.2177.7-78.1-64.7133.100112.3Y189 K196 V197 T216Y189-E193 HydrophobicContact CE2-CG 4.17Å; Y189-E193 PolarHBondContact O-N 3.1Å; Y189-E193 VanDerWaalsContact O-N 3.11Å; E193-K196 IonicContact OE1-NZ 2.67Å; E193-K196 PolarHBondContact OE1-NZ 2.66Å; E193-K196 IonicContact OE2-NZ 3.15Å; E193-V197 PolarHBondContact O-N 3.06Å; E193-T216 HydrophobicContact CB-CG2 3.94Å
194L98.6Very high97.7Very high0 Ų072.4 Ų72.40%036%0.358CS..Hα-helixtrans-64-43.2174.8-71.1168.8000112Q190 L191 E192 V197 F198 L212 L218 V223 W226 F227Q190-L194 WeakPolarHBondContact O-CB 3.42Å; Q190-L194 WeakPolarHBondContact O-CD1 3.28Å; Q190-L194 WeakPolarHBondContact O-CG 3.41Å; Q190-L194 PolarHBondContact O-N 2.8Å; Q190-L194 VanDerWaalsContact O-N 3.08Å; L191-L194 PolarHBondContact O-N 3.15Å; E192-L194 PolarHBondContact O-N 3.29Å; L194-V197 PolarHBondContact O-N 2.82Å; L194-F198 WeakPolarHBondContact O-CB 3.5Å; L194-F198 PolarHBondContact O-N 3.22Å; L194-L212 HydrophobicContact CD2-CD1 4.38Å; L194-L218 HydrophobicContact CD1-CD1 4.27Å; L194-V223 HydrophobicContact CD2-CB 4.48Å; L194-V223 HydrophobicContact CD2-CG1 3.84Å; L194-V223 HydrophobicContact CD2-CG2 4.27Å; L194-W226 HydrophobicContact CB-CD2 4.09Å; L194-W226 HydrophobicContact CB-CE3 3.96Å; L194-W226 HydrophobicContact CB-CH2 3.74Å; L194-W226 HydrophobicContact CB-CZ2 3.83Å; L194-W226 HydrophobicContact CB-CZ3 3.8Å; L194-W226 HydrophobicContact CD1-CB 4.47Å; L194-W226 HydrophobicContact CD1-CD2 3.84Å; L194-W226 HydrophobicContact CD1-CE3 4.39Å; L194-W226 HydrophobicContact CD1-CG 3.84Å; L194-W226 HydrophobicContact CD2-CE3 4.41Å; L194-W226 HydrophobicContact CG-CD2 4.41Å; L194-W226 HydrophobicContact CG-CE3 4.5Å; L194-F227 HydrophobicContact CD2-CD2 4.48Å; L194-F227 HydrophobicContact CD2-CE2 3.85Å
195E98.5Very high98.1Very high44 Ų4475.4 Ų75.421%0.20637%0.372CS..Hα-helixtrans-69.7-38.6179.2-168.266.1-147.600111.8L191 E192 V197 F198 Q199 W226 R230L191-E195 VanDerWaalsContact O-CB 3.26Å; L191-E195 WeakPolarHBondContact O-CB 3.43Å; L191-E195 PolarHBondContact O-N 3.08Å; E192-E195 PolarHBondContact O-N 3.18Å; E195-V197 VanDerWaalsContact C-N 3.29Å; E195-V197 PolarHBondContact O-N 3.41Å; E195-F198 CarbonylContact O-C 3.57Å; E195-F198 WeakPolarHBondContact O-CA 3.41Å; E195-F198 WeakPolarHBondContact O-CB 3.4Å; E195-F198 PolarHBondContact O-N 3.22Å; E195-Q199 WeakPolarHBondContact O-CG 3.49Å; E195-Q199 PolarHBondContact O-N 3.28Å; E195-W226 HydrophobicContact CB-CH2 4.49Å; E195-R230 VanDerWaalsContact CD-CZ 3.5Å; E195-R230 IonicContact OE1-CZ 3.26Å; E195-R230 VanDerWaalsContact OE1-CZ 3.26Å; E195-R230 IonicContact OE1-NE 3.33Å; E195-R230 PolarHBondContact OE1-NE 2.85Å; E195-R230 IonicContact OE1-NH2 3.56Å; E195-R230 PolarHBondContact OE1-NH2 3.28Å; E195-R230 IonicContact OE2-CZ 2.95Å; E195-R230 IonicContact OE2-NE 2.91Å; E195-R230 PolarHBondContact OE2-NE 3.38Å; E195-R230 IonicContact OE2-NH1 3.55Å; E195-R230 IonicContact OE2-NH2 2.77Å; E195-R230 PolarHBondContact OE2-NH2 3.02Å; E195-R230 VanDerWaalsContact OE2-NH2 3.15Å
196K98.3Very high98.2Very high96 Ų9672.7 Ų72.742%0.41736%0.355SS..Hα-helixtrans-57.5-40.1174.7174.3-180168.5-171.10112.3E192 E193E192-K196 VanDerWaalsContact O-CB 3.27Å; E192-K196 WeakPolarHBondContact O-CB 3.33Å; E192-K196 PolarHBondContact O-N 3.04Å; E193-K196 IonicContact OE1-NZ 2.67Å; E193-K196 PolarHBondContact OE1-NZ 2.66Å; E193-K196 IonicContact OE2-NZ 3.15Å
197V98.3Very high98.3Very high30 Ų3076.7 Ų76.718%0.18237%0.37CS..Hα-helixtrans-73.9-37.5173.1175.80000111.3E193 L194 E195 Q199 K200 T201 P204 L212 F227E193-V197 PolarHBondContact O-N 3.06Å; L194-V197 PolarHBondContact O-N 2.82Å; E195-V197 VanDerWaalsContact C-N 3.29Å; E195-V197 PolarHBondContact O-N 3.41Å; V197-Q199 VanDerWaalsContact C-N 3.25Å; V197-Q199 PolarHBondContact O-N 2.8Å; V197-K200 WeakPolarHBondContact O-CA 3.49Å; V197-K200 WeakPolarHBondContact O-CB 3.39Å; V197-K200 PolarHBondContact O-N 3.35Å; V197-T201 HydrophobicContact CG1-CG2 4.36Å; V197-T201 PolarHBondContact O-N 2.89Å; V197-P204 HydrophobicContact CG1-CB 4.45Å; V197-L212 HydrophobicContact CB-CD1 3.9Å; V197-L212 HydrophobicContact CB-CD2 4.46Å; V197-L212 HydrophobicContact CG1-CD1 3.88Å; V197-L212 HydrophobicContact CG2-CD1 3.9Å; V197-L212 HydrophobicContact CG2-CD2 3.73Å; V197-L212 HydrophobicContact CG2-CG 4.06Å; V197-F227 HydrophobicContact CB-CZ 4.21Å; V197-F227 HydrophobicContact CG1-CZ 4.02Å
198F98.4Very high98.3Very high5 Ų575 Ų752%0.02236%0.363CS..Hα-helixtrans-57.7-38.5176.3-169.7-98000112.6L194 E195 K200 T201 H202 W226 F227 R230 R231 W234L194-F198 WeakPolarHBondContact O-CB 3.5Å; L194-F198 PolarHBondContact O-N 3.22Å; E195-F198 CarbonylContact O-C 3.57Å; E195-F198 WeakPolarHBondContact O-CA 3.41Å; E195-F198 WeakPolarHBondContact O-CB 3.4Å; E195-F198 PolarHBondContact O-N 3.22Å; F198-K200 PolarHBondContact O-N 2.94Å; F198-T201 WeakPolarHBondContact CA-O 3.36Å; F198-T201 CarbonylContact O-C 3.6Å; F198-T201 PolarHBondContact O-N 2.79Å; F198-H202 AromaticContact CD1-CD2 3.61Å; F198-H202 AromaticContact CD1-NE2 3.99Å; F198-H202 AromaticContact CD2-CD2 3.92Å; F198-H202 AromaticContact CE1-CD2 3.19Å; F198-H202 WeakPolarHBondContact CE1-CD2 3.46Å; F198-H202 AromaticContact CE1-NE2 3.43Å; F198-H202 WeakPolarHBondContact CE1-NE2 3.44Å; F198-H202 HydrophobicContact CE2-CB 3.92Å; F198-H202 AromaticContact CE2-CD2 3.54Å; F198-H202 AromaticContact CE2-CG 3.98Å; F198-H202 AromaticContact CG-CD2 3.95Å; F198-H202 HydrophobicContact CZ-CB 4.17Å; F198-H202 AromaticContact CZ-CD2 3.15Å; F198-H202 WeakPolarHBondContact CZ-CD2 3.23Å; F198-H202 AromaticContact CZ-CG 3.75Å; F198-H202 AromaticContact CZ-NE2 3.73Å; F198-H202 PolarHBondContact O-CD2 2.76Å; F198-W226 HydrophobicContact CB-CH2 4.49Å; F198-W226 HydrophobicContact CB-CZ3 4.31Å; F198-W226 HydrophobicContact CD2-CZ3 4.45Å; F198-F227 HydrophobicContact CB-CE1 4.02Å; F198-F227 HydrophobicContact CB-CZ 4.49Å; F198-F227 AromaticContact CD2-CD1 3.77Å; F198-F227 HydrophobicContact CD2-CD1 3.77Å; F198-F227 AromaticContact CD2-CE1 3.73Å; F198-F227 HydrophobicContact CD2-CE1 3.73Å; F198-F227 HydrophobicContact CE2-CD1 4.45Å; F198-F227 HydrophobicContact CG-CE1 4.39Å; F198-R230 HydrophobicContact CD1-CG 3.92Å; F198-R230 HydrophobicContact CD2-CB 4.25Å; F198-R230 HydrophobicContact CD2-CG 3.57Å; F198-R230 HydrophobicContact CE1-CG 3.8Å; F198-R230 HydrophobicContact CE2-CB 4.02Å; F198-R230 HydrophobicContact CE2-CG 3.44Å; F198-R230 VanDerWaalsContact CE2-CG 3.44Å; F198-R230 HydrophobicContact CG-CG 3.82Å; F198-R230 HydrophobicContact CZ-CB 4.45Å; F198-R230 HydrophobicContact CZ-CG 3.56Å; F198-R231 HydrophobicContact CE2-CG 3.84Å; F198-R231 HydrophobicContact CZ-CG 4.36Å; F198-W234 HydrophobicContact CZ-CB 4.27Å; F198-W234 HydrophobicContact CZ-CG 4.38Å
199Q98.2Very high98.3Very high148 Ų14873.2 Ų73.269%0.69234%0.344SS*.Hα-helixtrans-61.2-32174-71.4172.3-4.500113.1E195 V197E195-Q199 WeakPolarHBondContact O-CG 3.49Å; E195-Q199 PolarHBondContact O-N 3.28Å; V197-Q199 VanDerWaalsContact C-N 3.25Å; V197-Q199 PolarHBondContact O-N 2.8Å
200K97.8Very high98.3Very high164 Ų16471.5 Ų71.571%0.71334%0.34SS*.Hα-helixtrans-80.9-43.6177.1-61.9178.6-178.6-1750111.8V197 F198V197-K200 WeakPolarHBondContact O-CA 3.49Å; V197-K200 WeakPolarHBondContact O-CB 3.39Å; V197-K200 PolarHBondContact O-N 3.35Å; F198-K200 PolarHBondContact O-N 2.94Å
201T97.8Very high98.3Very high58 Ų5874.1 Ų74.136%0.35635%0.352SS..  trans-151.9130.7177.61780000111.3V197 F198 Y203 P204V197-T201 HydrophobicContact CG1-CG2 4.36Å; V197-T201 PolarHBondContact O-N 2.89Å; F198-T201 WeakPolarHBondContact CA-O 3.36Å; F198-T201 CarbonylContact O-C 3.6Å; F198-T201 PolarHBondContact O-N 2.79Å; T201-Y203 PolarHBondContact O-N 2.98Å; T201-Y203 PolarHBondContact OG1-N 3.41Å; T201-Y203 VanDerWaalsContact OG1-N 3.13Å; T201-Y203 PolarHBondContact OG1-O 3.41Å; T201-P204 HydrophobicContact CG2-CB 4.26Å
202H98.1Very high98.3Very high59 Ų5971.1 Ų71.127%0.27334%0.337SS..SBendtrans-73.4-17.9172.8-59.5150.6000112.7F198 R231 W234F198-H202 AromaticContact CD1-CD2 3.61Å; F198-H202 AromaticContact CD1-NE2 3.99Å; F198-H202 AromaticContact CD2-CD2 3.92Å; F198-H202 AromaticContact CE1-CD2 3.19Å; F198-H202 WeakPolarHBondContact CE1-CD2 3.46Å; F198-H202 AromaticContact CE1-NE2 3.43Å; F198-H202 WeakPolarHBondContact CE1-NE2 3.44Å; F198-H202 HydrophobicContact CE2-CB 3.92Å; F198-H202 AromaticContact CE2-CD2 3.54Å; F198-H202 AromaticContact CE2-CG 3.98Å; F198-H202 AromaticContact CG-CD2 3.95Å; F198-H202 HydrophobicContact CZ-CB 4.17Å; F198-H202 AromaticContact CZ-CD2 3.15Å; F198-H202 WeakPolarHBondContact CZ-CD2 3.23Å; F198-H202 AromaticContact CZ-CG 3.75Å; F198-H202 AromaticContact CZ-NE2 3.73Å; F198-H202 PolarHBondContact O-CD2 2.76Å; H202-R231 HydrophobicContact CB-CG 4.31Å; H202-R231 VanDerWaalsContact O-CD 3.27Å; H202-R231 WeakPolarHBondContact O-CD 3.19Å; H202-R231 PolarHBondContact O-NH1 2.91Å; H202-W234 AromaticContact CE1-CE2 3.77Å; H202-W234 AromaticContact CE1-CZ2 3.93Å; H202-W234 AromaticContact CE1-NE1 3.79Å
203Y98.4Very high98.3Very high154 Ų15466 Ų6660%0.60431%0.314SS*.SBendtrans-127.174-175.7-65.4-92.8000110.2T201 R231T201-Y203 PolarHBondContact O-N 2.98Å; T201-Y203 PolarHBondContact OG1-N 3.41Å; T201-Y203 VanDerWaalsContact OG1-N 3.13Å; T201-Y203 PolarHBondContact OG1-O 3.41Å; Y203-R231 VanDerWaalsContact CE1-CD 3.43Å; Y203-R231 VanDerWaalsContact CE1-NE 3.29Å
204P98.1Very high98.3Very high4 Ų470.6 Ų70.63%0.02634%0.339CS..  trans-67.2137.6174.729.9-36.7000110.7V197 T201 A208 R209 F227V197-P204 HydrophobicContact CG1-CB 4.45Å; T201-P204 HydrophobicContact CG2-CB 4.26Å; P204-A208 HydrophobicContact CB-CB 4.07Å; P204-R209 HydrophobicContact CB-CG 4.03Å; P204-R209 HydrophobicContact CG-CG 3.8Å; P204-R209 PolarHBondContact O-NH1 3.35Å; P204-F227 VanDerWaalsContact CD-CD1 3.41Å; P204-F227 HydrophobicContact CG-CD1 3.59Å; P204-F227 HydrophobicContact CG-CD2 4.04Å; P204-F227 HydrophobicContact CG-CE1 3.52Å; P204-F227 HydrophobicContact CG-CE2 4Å; P204-F227 HydrophobicContact CG-CG 3.87Å; P204-F227 HydrophobicContact CG-CZ 3.76Å
205D98.4Very high98.3Very high112 Ų11278.1 Ų78.160%0.59937%0.368SS*.  trans-68.5166.8174-172.527.4000112Y207 A208 R209D205-Y207 PolarHBondContact O-N 3.14Å; D205-A208 PolarHBondContact O-N 3.41Å; D205-A208 VanDerWaalsContact O-N 3.16Å; D205-R209 WeakPolarHBondContact O-CG 3.26Å; D205-R209 PolarHBondContact O-N 3.32Å
206V98.2Very high98.2Very high66 Ų6676.1 Ų76.140%0.436%0.358SS..Hα-helixtrans-49.7-53.2180-178.40000110.9A208 R209 E210V206-A208 PolarHBondContact O-N 3.38Å; V206-R209 WeakPolarHBondContact O-CB 3.49Å; V206-R209 PolarHBondContact O-N 2.93Å; V206-E210 WeakPolarHBondContact O-CG 3.37Å; V206-E210 PolarHBondContact O-N 3.47Å
207Y98.3Very high98.2Very high148 Ų14878.5 Ų78.558%0.5838%0.375SS*.Hα-helixtrans-59.9-43.9179.8178.8-105.6000112.5D205 R209 E210 Q211D205-Y207 PolarHBondContact O-N 3.14Å; Y207-R209 VanDerWaalsContact C-N 3.28Å; Y207-R209 PolarHBondContact O-N 2.9Å; Y207-E210 PolarHBondContact O-N 3.4Å; Y207-Q211 HydrophobicContact CD1-CG 4.35Å; Y207-Q211 HydrophobicContact CE1-CG 3.93Å; Y207-Q211 HydrophobicContact CE2-CG 4.11Å; Y207-Q211 WeakPolarHBondContact O-CG 3.4Å; Y207-Q211 PolarHBondContact O-N 3.01Å
208A98.3Very high98.2Very high39 Ų3978.2 Ų78.232%0.32237%0.373SS..Hα-helixtrans-63.1-34.4176.800000112.4P204 D205 V206 L212P204-A208 HydrophobicContact CB-CB 4.07Å; D205-A208 PolarHBondContact O-N 3.41Å; D205-A208 VanDerWaalsContact O-N 3.16Å; V206-A208 PolarHBondContact O-N 3.38Å; A208-L212 PolarHBondContact O-N 3.28Å; A208-L212 VanDerWaalsContact O-N 3.13Å
209R98.6Very high98.2Very high44 Ų4482.1 Ų82.117%0.16640%0.397CS..Hα-helixtrans-71.7-37.8175.1-66.7-165.1-56.5-100.53.2112.2P204 D205 V206 Y207 L212 A213 E220 V223P204-R209 HydrophobicContact CB-CG 4.03Å; P204-R209 HydrophobicContact CG-CG 3.8Å; P204-R209 PolarHBondContact O-NH1 3.35Å; D205-R209 WeakPolarHBondContact O-CG 3.26Å; D205-R209 PolarHBondContact O-N 3.32Å; V206-R209 WeakPolarHBondContact O-CB 3.49Å; V206-R209 PolarHBondContact O-N 2.93Å; Y207-R209 VanDerWaalsContact C-N 3.28Å; Y207-R209 PolarHBondContact O-N 2.9Å; R209-L212 PolarHBondContact O-N 3.18Å; R209-A213 WeakPolarHBondContact O-CB 3.36Å; R209-A213 PolarHBondContact O-N 3.43Å; R209-E220 HydrophobicContact CB-CG 4.02Å; R209-E220 IonicContact CZ-OE1 3.35Å; R209-E220 IonicContact NE-OE1 2.89Å; R209-E220 PolarHBondContact NE-OE1 2.89Å; R209-E220 IonicContact NH2-OE1 3.01Å; R209-E220 PolarHBondContact NH2-OE1 3.19Å; R209-V223 HydrophobicContact CB-CG1 4.17Å; R209-V223 HydrophobicContact CG-CG1 4.18Å
210E98.6Very high98.2Very high89 Ų8977.5 Ų77.542%0.41638%0.376SS..Hα-helixtrans-62.8-45.5174.6-70.7173.4165.800111.3V206 Y207 L212 A213 L214 E220V206-E210 WeakPolarHBondContact O-CG 3.37Å; V206-E210 PolarHBondContact O-N 3.47Å; Y207-E210 PolarHBondContact O-N 3.4Å; E210-L212 VanDerWaalsContact C-N 3.31Å; E210-L212 PolarHBondContact O-N 3.42Å; E210-A213 WeakPolarHBondContact O-CB 3.36Å; E210-A213 PolarHBondContact O-N 3.08Å; E210-A213 VanDerWaalsContact O-N 3.16Å; E210-L214 WeakPolarHBondContact O-CG 3.43Å; E210-L214 PolarHBondContact O-N 3.2Å; E210-E220 HydrophobicContact CG-CG 4.12Å
211Q98.4Very high98.1Very high78 Ų7871.5 Ų71.536%0.36436%0.357SS..Hα-helixtrans-63-37.4176-64.5-57.286.500112.4Y207 R215Y207-Q211 HydrophobicContact CD1-CG 4.35Å; Y207-Q211 HydrophobicContact CE1-CG 3.93Å; Y207-Q211 HydrophobicContact CE2-CG 4.11Å; Y207-Q211 WeakPolarHBondContact O-CG 3.4Å; Y207-Q211 PolarHBondContact O-N 3.01Å; Q211-R215 VanDerWaalsContact O-CG 3.28Å; Q211-R215 WeakPolarHBondContact O-CG 3.43Å; Q211-R215 PolarHBondContact O-N 2.88Å; Q211-R215 VanDerWaalsContact O-N 3.1Å
212L98.3Very high98.2Very high7 Ų773.7 Ų73.74%0.03736%0.358CS..Hα-helixtrans-66.2-41.5173.2-88.2171.6000112.5L194 V197 A208 R209 E210 L214 R215 T216 V223 F227L194-L212 HydrophobicContact CD2-CD1 4.38Å; V197-L212 HydrophobicContact CB-CD1 3.9Å; V197-L212 HydrophobicContact CB-CD2 4.46Å; V197-L212 HydrophobicContact CG1-CD1 3.88Å; V197-L212 HydrophobicContact CG2-CD1 3.9Å; V197-L212 HydrophobicContact CG2-CD2 3.73Å; V197-L212 HydrophobicContact CG2-CG 4.06Å; A208-L212 PolarHBondContact O-N 3.28Å; A208-L212 VanDerWaalsContact O-N 3.13Å; R209-L212 PolarHBondContact O-N 3.18Å; E210-L212 VanDerWaalsContact C-N 3.31Å; E210-L212 PolarHBondContact O-N 3.42Å; L212-L214 VanDerWaalsContact C-N 3.31Å; L212-L214 PolarHBondContact O-N 3.41Å; L212-R215 PolarHBondContact O-N 3.18Å; L212-T216 WeakPolarHBondContact O-CB 3.33Å; L212-T216 WeakPolarHBondContact O-CG2 3.1Å; L212-T216 PolarHBondContact O-N 3.35Å; L212-T216 PolarHBondContact O-OG1 3.13Å; L212-V223 HydrophobicContact CB-CG1 4.22Å; L212-V223 HydrophobicContact CD1-CG1 4.22Å; L212-F227 HydrophobicContact CD1-CE2 3.85Å; L212-F227 HydrophobicContact CD1-CZ 4.08Å
213A98.5Very high98.2Very high9 Ų970.9 Ų70.97%0.07435%0.345CS..Hα-helixtrans-57.9-46.1178.200000110.7R209 E210 T216 D217 L218 E220 V223R209-A213 WeakPolarHBondContact O-CB 3.36Å; R209-A213 PolarHBondContact O-N 3.43Å; E210-A213 WeakPolarHBondContact O-CB 3.36Å; E210-A213 PolarHBondContact O-N 3.08Å; E210-A213 VanDerWaalsContact O-N 3.16Å; A213-T216 PolarHBondContact O-N 2.97Å; A213-D217 PolarHBondContact O-N 3.05Å; A213-L218 CarbonylContact C-O 3.32Å; A213-L218 WeakPolarHBondContact CA-O 3.26Å; A213-L218 VanDerWaalsContact CB-O 3.23Å; A213-L218 WeakPolarHBondContact CB-O 3.47Å; A213-L218 PolarHBondContact O-N 3Å; A213-E220 HydrophobicContact CB-CB 4.39Å; A213-V223 HydrophobicContact CB-CG2 4.12Å
214L98.3Very high98.2Very high128 Ų12866.9 Ų66.967%0.6733%0.332SS*.Hα-helixtrans-62.7-43.6174.4-66.8172.8000112.7E210 L212 T216E210-L214 WeakPolarHBondContact O-CG 3.43Å; E210-L214 PolarHBondContact O-N 3.2Å; L212-L214 VanDerWaalsContact C-N 3.31Å; L212-L214 PolarHBondContact O-N 3.41Å; L214-T216 VanDerWaalsContact C-N 3.33Å; L214-T216 PolarHBondContact O-N 3.31Å
215R97.9Very high98.2Very high159 Ų15969.6 Ų69.660%0.635%0.349SS*.Hα-helixtrans-70.3-27.4-179-70.8178100.188.84.9114Q211 L212Q211-R215 VanDerWaalsContact O-CG 3.28Å; Q211-R215 WeakPolarHBondContact O-CG 3.43Å; Q211-R215 PolarHBondContact O-N 2.88Å; Q211-R215 VanDerWaalsContact O-N 3.1Å; L212-R215 PolarHBondContact O-N 3.18Å
216T97.8Very high98.2Very high2 Ų265.5 Ų65.51%0.01233%0.325CS..Hα-helixtrans-105.71-17457.30000113.3Q190 E193 L212 A213 L214 L218Q190-T216 WeakPolarHBondContact CG-O 3.49Å; Q190-T216 PolarHBondContact NE2-O 2.89Å; E193-T216 HydrophobicContact CB-CG2 3.94Å; L212-T216 WeakPolarHBondContact O-CB 3.33Å; L212-T216 WeakPolarHBondContact O-CG2 3.1Å; L212-T216 PolarHBondContact O-N 3.35Å; L212-T216 PolarHBondContact O-OG1 3.13Å; A213-T216 PolarHBondContact O-N 2.97Å; L214-T216 VanDerWaalsContact C-N 3.33Å; L214-T216 PolarHBondContact O-N 3.31Å; T216-L218 VanDerWaalsContact C-N 3.26Å; T216-L218 PolarHBondContact O-N 3.35Å
217D98.1Very high98.2Very high145 Ų14562.4 Ų62.478%0.77531%0.306SS*.THydrogen-bonded Turntrans52.543.1-173.5-60.5-48.2000112.9A213A213-D217 PolarHBondContact O-N 3.05Å
218L97.1Very high98.2Very high25 Ų2559.5 Ų59.513%0.13130%0.298CS..  trans-117.7160.6176.6-65.1174.3000109.8T184 F186 Q190 L194 A213 T216 R222 V223T184-L218 HydrophobicContact CG2-CD2 4.5Å; F186-L218 HydrophobicContact CD1-CD1 3.72Å; F186-L218 HydrophobicContact CD1-CD2 4.13Å; F186-L218 HydrophobicContact CE1-CD1 3.62Å; F186-L218 HydrophobicContact CE1-CD2 4.05Å; F186-L218 HydrophobicContact CE1-CG 4.5Å; Q190-L218 HydrophobicContact CB-CD1 4.47Å; Q190-L218 HydrophobicContact CG-CD1 4.47Å; L194-L218 HydrophobicContact CD1-CD1 4.27Å; A213-L218 CarbonylContact C-O 3.32Å; A213-L218 WeakPolarHBondContact CA-O 3.26Å; A213-L218 VanDerWaalsContact CB-O 3.23Å; A213-L218 WeakPolarHBondContact CB-O 3.47Å; A213-L218 PolarHBondContact O-N 3Å; T216-L218 VanDerWaalsContact C-N 3.26Å; T216-L218 PolarHBondContact O-N 3.35Å; L218-R222 HydrophobicContact CB-CB 4.33Å; L218-V223 HydrophobicContact CB-CG2 4.22Å
219T98.1Very high98.2Very high86 Ų8662 Ų6253%0.52831%0.306SS..  trans-77.8148.9167.970.20000110.6A221 R222 V223T219-A221 PolarHBondContact O-N 3.48Å; T219-A221 VanDerWaalsContact O-N 3.15Å; T219-R222 WeakPolarHBondContact O-CA 3.43Å; T219-R222 WeakPolarHBondContact O-CB 3.46Å; T219-R222 PolarHBondContact O-N 3.46Å; T219-R222 WeakPolarHBondContact OG1-CG 3.27Å; T219-R222 PolarHBondContact OG1-N 3.22Å; T219-V223 PolarHBondContact O-N 3.08Å
220E98.2Very high98.1Very high51 Ų5162.8 Ų62.824%0.23831%0.309CS..Hα-helixtrans-50.9-41.2176.6-175.3-80.7161.200111.3R209 E210 A213 R222 V223 Q224R209-E220 HydrophobicContact CB-CG 4.02Å; R209-E220 IonicContact CZ-OE1 3.35Å; R209-E220 IonicContact NE-OE1 2.89Å; R209-E220 PolarHBondContact NE-OE1 2.89Å; R209-E220 IonicContact NH2-OE1 3.01Å; R209-E220 PolarHBondContact NH2-OE1 3.19Å; E210-E220 HydrophobicContact CG-CG 4.12Å; A213-E220 HydrophobicContact CB-CB 4.39Å; E220-R222 VanDerWaalsContact C-N 3.31Å; E220-R222 PolarHBondContact O-N 3.34Å; E220-V223 CarbonylContact O-C 3.45Å; E220-V223 WeakPolarHBondContact O-CA 3.27Å; E220-V223 WeakPolarHBondContact O-CB 3.38Å; E220-V223 PolarHBondContact O-N 2.87Å; E220-V223 VanDerWaalsContact O-N 3.08Å; E220-Q224 WeakPolarHBondContact O-CB 3.38Å; E220-Q224 PolarHBondContact O-N 3.11Å
221A97.7Very high98.1Very high39 Ų3960.5 Ų60.532%0.32230%0.296SS..Hα-helixtrans-60.3-36176.300000113.2T219 V225T219-A221 PolarHBondContact O-N 3.48Å; T219-A221 VanDerWaalsContact O-N 3.15Å; A221-V225 WeakPolarHBondContact O-CB 3.36Å; A221-V225 VanDerWaalsContact O-CG2 3.26Å; A221-V225 WeakPolarHBondContact O-CG2 3.48Å; A221-V225 PolarHBondContact O-N 2.91Å
222R97.9Very high98Very high103 Ų10358.7 Ų58.739%0.38929%0.294SS..Hα-helixtrans-67.3-42.3174.4-67.7-59.298.6148.58.5111.1T184 L218 T219 E220 V225 W226T184-R222 WeakPolarHBondContact OG1-CD 3.34Å; T184-R222 PolarHBondContact OG1-NH1 3.5Å; L218-R222 HydrophobicContact CB-CB 4.33Å; T219-R222 WeakPolarHBondContact O-CA 3.43Å; T219-R222 WeakPolarHBondContact O-CB 3.46Å; T219-R222 PolarHBondContact O-N 3.46Å; T219-R222 WeakPolarHBondContact OG1-CG 3.27Å; T219-R222 PolarHBondContact OG1-N 3.22Å; E220-R222 VanDerWaalsContact C-N 3.31Å; E220-R222 PolarHBondContact O-N 3.34Å; R222-V225 PolarHBondContact O-N 3.31Å; R222-W226 WeakPolarHBondContact O-CB 3.45Å; R222-W226 PolarHBondContact O-N 2.92Å
223V98.4Very high97.9Very high0 Ų064.3 Ų64.30%032%0.319CS..Hα-helixtrans-60.6-48.21751780000109.8L194 R209 L212 A213 L218 T219 E220 V225 W226 F227L194-V223 HydrophobicContact CD2-CB 4.48Å; L194-V223 HydrophobicContact CD2-CG1 3.84Å; L194-V223 HydrophobicContact CD2-CG2 4.27Å; R209-V223 HydrophobicContact CB-CG1 4.17Å; R209-V223 HydrophobicContact CG-CG1 4.18Å; L212-V223 HydrophobicContact CB-CG1 4.22Å; L212-V223 HydrophobicContact CD1-CG1 4.22Å; A213-V223 HydrophobicContact CB-CG2 4.12Å; L218-V223 HydrophobicContact CB-CG2 4.22Å; T219-V223 PolarHBondContact O-N 3.08Å; E220-V223 CarbonylContact O-C 3.45Å; E220-V223 WeakPolarHBondContact O-CA 3.27Å; E220-V223 WeakPolarHBondContact O-CB 3.38Å; E220-V223 PolarHBondContact O-N 2.87Å; E220-V223 VanDerWaalsContact O-N 3.08Å; V223-V225 PolarHBondContact O-N 3.45Å; V223-W226 WeakPolarHBondContact O-CB 3.26Å; V223-W226 PolarHBondContact O-N 2.94Å; V223-W226 VanDerWaalsContact O-N 3.14Å; V223-F227 HydrophobicContact CG1-CD2 3.79Å; V223-F227 HydrophobicContact CG1-CE2 3.83Å; V223-F227 WeakPolarHBondContact O-CD2 3.37Å; V223-F227 PolarHBondContact O-N 3.39Å
224Q98.3Very high97.7Very high71 Ų7169.1 Ų69.133%0.33234%0.335SS..Hα-helixtrans-56.2-49.3177.3-169.4-164.9-6.800112E220 W226 F227 Q228E220-Q224 WeakPolarHBondContact O-CB 3.38Å; E220-Q224 PolarHBondContact O-N 3.11Å; Q224-W226 VanDerWaalsContact C-N 3.32Å; Q224-W226 PolarHBondContact O-N 3.47Å; Q224-F227 PolarHBondContact O-N 2.81Å; Q224-Q228 WeakPolarHBondContact O-CG 3.46Å; Q224-Q228 PolarHBondContact O-N 3.2Å
225V98.1Very high97.6Very high61 Ų6168.8 Ų68.837%0.3733%0.325SS..Hα-helixtrans-63.8-38.5177.9170.90000111.4A221 R222 V223 Q228 N229A221-V225 WeakPolarHBondContact O-CB 3.36Å; A221-V225 VanDerWaalsContact O-CG2 3.26Å; A221-V225 WeakPolarHBondContact O-CG2 3.48Å; A221-V225 PolarHBondContact O-N 2.91Å; R222-V225 PolarHBondContact O-N 3.31Å; V223-V225 PolarHBondContact O-N 3.45Å; V225-Q228 PolarHBondContact O-N 3Å; V225-N229 WeakPolarHBondContact O-CB 3.47Å; V225-N229 PolarHBondContact O-N 3.12Å; V225-N229 PolarHBondContact O-ND2 3.42Å
226W98.2Very high97.3Very high25 Ų2567.1 Ų67.110%0.09532%0.322CS..Hα-helixtrans-60.6-48.8175.5-172.8102.6000111.2F186 L191 L194 E195 F198 R222 V223 Q224 Q228 N229 R230F186-W226 AromaticContact CD2-CD1 3.87Å; F186-W226 AromaticContact CE2-CD1 3.59Å; F186-W226 HydrophobicContact CZ-CB 4.33Å; F186-W226 AromaticContact CZ-CD1 3.87Å; L191-W226 HydrophobicContact CD2-CZ2 4.35Å; L191-W226 VanDerWaalsContact CD2-NE1 3.27Å; L194-W226 HydrophobicContact CB-CD2 4.09Å; L194-W226 HydrophobicContact CB-CE3 3.96Å; L194-W226 HydrophobicContact CB-CH2 3.74Å; L194-W226 HydrophobicContact CB-CZ2 3.83Å; L194-W226 HydrophobicContact CB-CZ3 3.8Å; L194-W226 HydrophobicContact CD1-CB 4.47Å; L194-W226 HydrophobicContact CD1-CD2 3.84Å; L194-W226 HydrophobicContact CD1-CE3 4.39Å; L194-W226 HydrophobicContact CD1-CG 3.84Å; L194-W226 HydrophobicContact CD2-CE3 4.41Å; L194-W226 HydrophobicContact CG-CD2 4.41Å; L194-W226 HydrophobicContact CG-CE3 4.5Å; E195-W226 HydrophobicContact CB-CH2 4.49Å; F198-W226 HydrophobicContact CB-CH2 4.49Å; F198-W226 HydrophobicContact CB-CZ3 4.31Å; F198-W226 HydrophobicContact CD2-CZ3 4.45Å; R222-W226 WeakPolarHBondContact O-CB 3.45Å; R222-W226 PolarHBondContact O-N 2.92Å; V223-W226 WeakPolarHBondContact O-CB 3.26Å; V223-W226 PolarHBondContact O-N 2.94Å; V223-W226 VanDerWaalsContact O-N 3.14Å; Q224-W226 VanDerWaalsContact C-N 3.32Å; Q224-W226 PolarHBondContact O-N 3.47Å; W226-Q228 VanDerWaalsContact C-N 3.34Å; W226-Q228 PolarHBondContact O-N 3.03Å; W226-N229 PolarHBondContact O-N 3.11Å; W226-R230 HydrophobicContact CE3-CB 4.04Å; W226-R230 HydrophobicContact CH2-CB 4.17Å; W226-R230 HydrophobicContact CH2-CG 3.85Å; W226-R230 HydrophobicContact CZ3-CB 3.83Å; W226-R230 HydrophobicContact CZ3-CG 3.84Å; W226-R230 WeakPolarHBondContact O-CB 3.31Å; W226-R230 PolarHBondContact O-N 3.18Å
227F98.7Very high96.7Very high2 Ų275.2 Ų75.21%0.00935%0.352CS..Hα-helixtrans-63-38.3178.3-90.1-90.5000112.4L194 V197 F198 P204 L212 V223 Q224 R230 R231L194-F227 HydrophobicContact CD2-CD2 4.48Å; L194-F227 HydrophobicContact CD2-CE2 3.85Å; V197-F227 HydrophobicContact CB-CZ 4.21Å; V197-F227 HydrophobicContact CG1-CZ 4.02Å; F198-F227 HydrophobicContact CB-CE1 4.02Å; F198-F227 HydrophobicContact CB-CZ 4.49Å; F198-F227 AromaticContact CD2-CD1 3.77Å; F198-F227 HydrophobicContact CD2-CD1 3.77Å; F198-F227 AromaticContact CD2-CE1 3.73Å; F198-F227 HydrophobicContact CD2-CE1 3.73Å; F198-F227 HydrophobicContact CE2-CD1 4.45Å; F198-F227 HydrophobicContact CG-CE1 4.39Å; P204-F227 VanDerWaalsContact CD-CD1 3.41Å; P204-F227 HydrophobicContact CG-CD1 3.59Å; P204-F227 HydrophobicContact CG-CD2 4.04Å; P204-F227 HydrophobicContact CG-CE1 3.52Å; P204-F227 HydrophobicContact CG-CE2 4Å; P204-F227 HydrophobicContact CG-CG 3.87Å; P204-F227 HydrophobicContact CG-CZ 3.76Å; L212-F227 HydrophobicContact CD1-CE2 3.85Å; L212-F227 HydrophobicContact CD1-CZ 4.08Å; V223-F227 HydrophobicContact CG1-CD2 3.79Å; V223-F227 HydrophobicContact CG1-CE2 3.83Å; V223-F227 WeakPolarHBondContact O-CD2 3.37Å; V223-F227 PolarHBondContact O-N 3.39Å; Q224-F227 PolarHBondContact O-N 2.81Å; F227-R230 PolarHBondContact O-N 3.41Å; F227-R231 WeakPolarHBondContact O-CB 3.43Å; F227-R231 WeakPolarHBondContact O-CG 3.15Å; F227-R231 PolarHBondContact O-N 3.15Å
228Q98.4Very high95.6Very high86 Ų8674.4 Ų74.440%0.40234%0.344SS..Hα-helixtrans-60.4-48.6173.1-72.2176.935.900111.8Q224 V225 W226 R230 R231 A232Q224-Q228 WeakPolarHBondContact O-CG 3.46Å; Q224-Q228 PolarHBondContact O-N 3.2Å; V225-Q228 PolarHBondContact O-N 3Å; W226-Q228 VanDerWaalsContact C-N 3.34Å; W226-Q228 PolarHBondContact O-N 3.03Å; Q228-R230 VanDerWaalsContact C-N 3.33Å; Q228-R230 PolarHBondContact O-N 3.14Å; Q228-R231 PolarHBondContact O-N 2.67Å; Q228-A232 WeakPolarHBondContact O-CB 3.39Å; Q228-A232 PolarHBondContact O-N 3.49Å
229N97.9Very high94.2Very high93 Ų9382.4 Ų82.450%0.49737%0.372SS..Hα-helixtrans-64.8-37.5178.1-74.4-34000112.2V225 W226 A232 K233V225-N229 WeakPolarHBondContact O-CB 3.47Å; V225-N229 PolarHBondContact O-N 3.12Å; V225-N229 PolarHBondContact O-ND2 3.42Å; W226-N229 PolarHBondContact O-N 3.11Å; N229-A232 PolarHBondContact O-N 3.33Å; N229-K233 PolarHBondContact O-N 2.92Å; N229-K233 VanDerWaalsContact O-N 3.08Å
230R97.9Very high92.3Very high59 Ų5982.8 Ų82.822%0.22337%0.367CS..Hα-helixtrans-64.6-49.1176.7-17467.4-172.9172.50.7110.9E195 F198 W226 F227 Q228 A232 K233 W234E195-R230 VanDerWaalsContact CD-CZ 3.5Å; E195-R230 IonicContact OE1-CZ 3.26Å; E195-R230 VanDerWaalsContact OE1-CZ 3.26Å; E195-R230 IonicContact OE1-NE 3.33Å; E195-R230 PolarHBondContact OE1-NE 2.85Å; E195-R230 IonicContact OE1-NH2 3.56Å; E195-R230 PolarHBondContact OE1-NH2 3.28Å; E195-R230 IonicContact OE2-CZ 2.95Å; E195-R230 IonicContact OE2-NE 2.91Å; E195-R230 PolarHBondContact OE2-NE 3.38Å; E195-R230 IonicContact OE2-NH1 3.55Å; E195-R230 IonicContact OE2-NH2 2.77Å; E195-R230 PolarHBondContact OE2-NH2 3.02Å; E195-R230 VanDerWaalsContact OE2-NH2 3.15Å; F198-R230 HydrophobicContact CD1-CG 3.92Å; F198-R230 HydrophobicContact CD2-CB 4.25Å; F198-R230 HydrophobicContact CD2-CG 3.57Å; F198-R230 HydrophobicContact CE1-CG 3.8Å; F198-R230 HydrophobicContact CE2-CB 4.02Å; F198-R230 HydrophobicContact CE2-CG 3.44Å; F198-R230 VanDerWaalsContact CE2-CG 3.44Å; F198-R230 HydrophobicContact CG-CG 3.82Å; F198-R230 HydrophobicContact CZ-CB 4.45Å; F198-R230 HydrophobicContact CZ-CG 3.56Å; W226-R230 HydrophobicContact CE3-CB 4.04Å; W226-R230 HydrophobicContact CH2-CB 4.17Å; W226-R230 HydrophobicContact CH2-CG 3.85Å; W226-R230 HydrophobicContact CZ3-CB 3.83Å; W226-R230 HydrophobicContact CZ3-CG 3.84Å; W226-R230 WeakPolarHBondContact O-CB 3.31Å; W226-R230 PolarHBondContact O-N 3.18Å; F227-R230 PolarHBondContact O-N 3.41Å; Q228-R230 VanDerWaalsContact C-N 3.33Å; Q228-R230 PolarHBondContact O-N 3.14Å; R230-A232 VanDerWaalsContact C-N 3.32Å; R230-A232 PolarHBondContact O-N 2.93Å; R230-K233 PolarHBondContact O-N 3.22Å; R230-W234 WeakPolarHBondContact O-CB 3.49Å; R230-W234 PolarHBondContact O-N 3.08Å
231R97.8Very high90.5Very high42 Ų4282.8 Ų82.816%0.15838%0.38CS..Hα-helixtrans-61.1-37.8174.6-72.8-165-62.6-88.52.7113F198 H202 Y203 F227 Q228 W234 R235F198-R231 HydrophobicContact CE2-CG 3.84Å; F198-R231 HydrophobicContact CZ-CG 4.36Å; H202-R231 HydrophobicContact CB-CG 4.31Å; H202-R231 VanDerWaalsContact O-CD 3.27Å; H202-R231 WeakPolarHBondContact O-CD 3.19Å; H202-R231 PolarHBondContact O-NH1 2.91Å; Y203-R231 VanDerWaalsContact CE1-CD 3.43Å; Y203-R231 VanDerWaalsContact CE1-NE 3.29Å; F227-R231 WeakPolarHBondContact O-CB 3.43Å; F227-R231 WeakPolarHBondContact O-CG 3.15Å; F227-R231 PolarHBondContact O-N 3.15Å; Q228-R231 PolarHBondContact O-N 2.67Å; R231-W234 PolarHBondContact O-N 2.98Å; R231-R235 WeakPolarHBondContact O-CG 3.49Å; R231-R235 PolarHBondContact O-N 3.4Å
232A97.3Very high88.5Confident39 Ų3988.6 Ų88.632%0.32240%0.401SS..Hα-helixtrans-61.9-45175.900000111.7Q228 N229 R230 K236Q228-A232 WeakPolarHBondContact O-CB 3.39Å; Q228-A232 PolarHBondContact O-N 3.49Å; N229-A232 PolarHBondContact O-N 3.33Å; R230-A232 VanDerWaalsContact C-N 3.32Å; R230-A232 PolarHBondContact O-N 2.93Å; A232-K236 WeakPolarHBondContact O-CB 3.4Å; A232-K236 PolarHBondContact O-N 3.34Å
233K95.6Very high86.4Confident125 Ų12589.4 Ų89.454%0.54341%0.41SS..Hα-helixtrans-63.8-41.5174.6-76.5-176.4-78.9-178.40112.1N229 R230 K236 R237N229-K233 PolarHBondContact O-N 2.92Å; N229-K233 VanDerWaalsContact O-N 3.08Å; R230-K233 PolarHBondContact O-N 3.22Å; K233-K236 PolarHBondContact O-N 2.73Å; K233-R237 PolarHBondContact O-N 3.21Å
234W94.9Very high84.3Confident111 Ų11195.1 Ų95.142%0.4244%0.437SS..Hα-helixtrans-59.6-52.5177.3-176.289.1000111.5F198 H202 R230 R231 K236 R237 E238F198-W234 HydrophobicContact CZ-CB 4.27Å; F198-W234 HydrophobicContact CZ-CG 4.38Å; H202-W234 AromaticContact CE1-CE2 3.77Å; H202-W234 AromaticContact CE1-CZ2 3.93Å; H202-W234 AromaticContact CE1-NE1 3.79Å; R230-W234 WeakPolarHBondContact O-CB 3.49Å; R230-W234 PolarHBondContact O-N 3.08Å; R231-W234 PolarHBondContact O-N 2.98Å; W234-K236 VanDerWaalsContact C-N 3.27Å; W234-K236 PolarHBondContact O-N 3.03Å; W234-R237 PolarHBondContact O-N 3.02Å; W234-R237 VanDerWaalsContact O-N 3.16Å; W234-E238 PolarHBondContact O-N 2.7Å
235R95.1Very high82.1Confident120 Ų12097.6 Ų97.645%0.45345%0.449SS..Hα-helixtrans-61.1-34.1175.3-72.4-172.5-77.297.8-4.6113R231 R239R231-R235 WeakPolarHBondContact O-CG 3.49Å; R231-R235 PolarHBondContact O-N 3.4Å; R235-R239 PolarHBondContact O-N 3.45Å
236K91.2Very high80Confident125 Ų12599.4 Ų99.454%0.54346%0.46SS..Hα-helixtrans-67.9-40.7177.3-170.6174.9-177.1-178.80111.3A232 K233 W234 E238 R239 F240A232-K236 WeakPolarHBondContact O-CB 3.4Å; A232-K236 PolarHBondContact O-N 3.34Å; K233-K236 PolarHBondContact O-N 2.73Å; W234-K236 VanDerWaalsContact C-N 3.27Å; W234-K236 PolarHBondContact O-N 3.03Å; K236-E238 VanDerWaalsContact C-N 3.32Å; K236-E238 PolarHBondContact O-N 3.38Å; K236-R239 PolarHBondContact O-N 3.04Å; K236-F240 HydrophobicContact CD-CD2 4.29Å; K236-F240 HydrophobicContact CD-CE2 4.01Å; K236-F240 HydrophobicContact CG-CD2 3.47Å; K236-F240 VanDerWaalsContact CG-CD2 3.47Å; K236-F240 HydrophobicContact CG-CE2 3.59Å; K236-F240 WeakPolarHBondContact O-CB 3.35Å; K236-F240 VanDerWaalsContact O-CD2 3.31Å; K236-F240 WeakPolarHBondContact O-CD2 3.5Å; K236-F240 PolarHBondContact O-N 2.96Å
237R86.3Confident77.8Confident171 Ų171107.6 Ų107.665%0.64549%0.491SS*.Hα-helixtrans-60.4-42.7178.9-175.3175.2-67.7149.6-3.5111.9K233 W234 R239 F240 G241K233-R237 PolarHBondContact O-N 3.21Å; W234-R237 PolarHBondContact O-N 3.02Å; W234-R237 VanDerWaalsContact O-N 3.16Å; R237-R239 VanDerWaalsContact C-N 3.34Å; R237-R239 PolarHBondContact O-N 3.44Å; R237-F240 PolarHBondContact O-N 3.16Å; R237-G241 PolarHBondContact O-N 2.94Å; R237-G241 VanDerWaalsContact O-N 3.1Å
238E74.3Confident75.6Confident128 Ų128111.1 Ų111.160%0.59851%0.512SS*.Hα-helixtrans-62-40.4177.8-165.9177.4-16200112.3W234 K236W234-E238 PolarHBondContact O-N 2.7Å; K236-E238 VanDerWaalsContact C-N 3.32Å; K236-E238 PolarHBondContact O-N 3.38Å
239R67.4Low73.4Confident194 Ų194112.8 Ų112.873%0.73252%0.52SS*.Hα-helixtrans-75.2-32.3177.5-66.7-173.5-176.2-148.9-0.3114R235 K236 R237 M243R235-R239 PolarHBondContact O-N 3.45Å; K236-R239 PolarHBondContact O-N 3.04Å; R237-R239 VanDerWaalsContact C-N 3.34Å; R237-R239 PolarHBondContact O-N 3.44Å; R239-M243 PolarHBondContact O-N 3.35Å
240F59.2Low71.2Confident93 Ų93114.9 Ų114.941%0.40853%0.525SS..Hα-helixtrans-77.4-24.6179.4-89.6-99.7000112.8K236 R237 Q242 M243 Q244K236-F240 HydrophobicContact CD-CD2 4.29Å; K236-F240 HydrophobicContact CD-CE2 4.01Å; K236-F240 HydrophobicContact CG-CD2 3.47Å; K236-F240 VanDerWaalsContact CG-CD2 3.47Å; K236-F240 HydrophobicContact CG-CE2 3.59Å; K236-F240 WeakPolarHBondContact O-CB 3.35Å; K236-F240 VanDerWaalsContact O-CD2 3.31Å; K236-F240 WeakPolarHBondContact O-CD2 3.5Å; K236-F240 PolarHBondContact O-N 2.96Å; R237-F240 PolarHBondContact O-N 3.16Å; F240-Q242 VanDerWaalsContact C-N 3.25Å; F240-Q242 PolarHBondContact O-N 3.27Å; F240-M243 PolarHBondContact O-N 3.29Å; F240-Q244 VanDerWaalsContact O-CB 3.24Å; F240-Q244 WeakPolarHBondContact O-CB 3.36Å; F240-Q244 PolarHBondContact O-N 2.97Å
241G59.5Low69Low51 Ų51116 Ų11653%0.52654%0.542SS..Hα-helixtrans-58.6-34.1172.300000113.7R237R237-G241 PolarHBondContact O-N 2.94Å; R237-G241 VanDerWaalsContact O-N 3.1Å
242Q56.4Low66.9Low161 Ų161118 Ų11875%0.75256%0.559SS**Hα-helixtrans-84.7-38177.6-66.1-1756.700113.2F240F240-Q242 VanDerWaalsContact C-N 3.25Å; F240-Q242 PolarHBondContact O-N 3.27Å
243M53.6Low64.9Low120 Ų120119.4 Ų119.459%0.59157%0.571SS**Hα-helixtrans-74.5-28.4-178.5-172.167.572.500112.8R239 F240 Q245 V246 R247R239-M243 PolarHBondContact O-N 3.35Å; F240-M243 PolarHBondContact O-N 3.29Å; M243-Q245 VanDerWaalsContact C-N 3.26Å; M243-Q245 PolarHBondContact O-N 2.94Å; M243-V246 PolarHBondContact O-N 3.26Å; M243-V246 VanDerWaalsContact O-N 3.17Å; M243-R247 PolarHBondContact O-N 3.35Å
244Q53.1Low62.7Low120 Ų120121.6 Ų121.656%0.56158%0.577SS**Hα-helixtrans-72-21.6-177.7-153.9147.427.300112.4F240 R247 T248F240-Q244 VanDerWaalsContact O-CB 3.24Å; F240-Q244 WeakPolarHBondContact O-CB 3.36Å; F240-Q244 PolarHBondContact O-N 2.97Å; Q244-R247 PolarHBondContact O-N 3.37Å; Q244-T248 WeakPolarHBondContact O-CB 3.49Å; Q244-T248 PolarHBondContact O-N 3.36Å; Q244-T248 PolarHBondContact O-OG1 3.1Å
245Q52.3Low60.3Low124 Ų124124.1 Ų124.158%0.57959%0.593SS**Hα-helixtrans-60.6-43.8167.7-68.2-150.4-19.600111.2M243 R247 T248 H249M243-Q245 VanDerWaalsContact C-N 3.26Å; M243-Q245 PolarHBondContact O-N 2.94Å; Q245-R247 VanDerWaalsContact C-N 3.33Å; Q245-R247 PolarHBondContact O-N 2.93Å; Q245-T248 WeakPolarHBondContact CA-OG1 3.31Å; Q245-T248 PolarHBondContact O-N 3.17Å; Q245-T248 PolarHBondContact O-OG1 3.46Å; Q245-H249 WeakPolarHBondContact O-CB 3.41Å; Q245-H249 PolarHBondContact O-CD2 3.35Å; Q245-H249 PolarHBondContact O-N 3.21Å
246V54.2Low57.9Low99 Ų99125.1 Ų125.160%0.661%0.607SS**Hα-helixtrans-66.4-35.9179-172.50000112.1M243 F250M243-V246 PolarHBondContact O-N 3.26Å; M243-V246 VanDerWaalsContact O-N 3.17Å; V246-F250 PolarHBondContact O-N 3.45Å
247R51.9Low55.7Low197 Ų197124.6 Ų124.674%0.74362%0.616SS**Hα-helixtrans-76-31.4175.3-103.2-179164.6165.6-3.8114M243 Q244 Q245 S251M243-R247 PolarHBondContact O-N 3.35Å; Q244-R247 PolarHBondContact O-N 3.37Å; Q245-R247 VanDerWaalsContact C-N 3.33Å; Q245-R247 PolarHBondContact O-N 2.93Å; R247-S251 PolarHBondContact O-N 3.03Å
248T53.6Low53.7Low75 Ų75124.1 Ų124.146%0.4663%0.625SS.*Hα-helixtrans-74.3-36.7172.234.40000111Q244 Q245 F250 S251 T252Q244-T248 WeakPolarHBondContact O-CB 3.49Å; Q244-T248 PolarHBondContact O-N 3.36Å; Q244-T248 PolarHBondContact O-OG1 3.1Å; Q245-T248 WeakPolarHBondContact CA-OG1 3.31Å; Q245-T248 PolarHBondContact O-N 3.17Å; Q245-T248 PolarHBondContact O-OG1 3.46Å; T248-F250 VanDerWaalsContact C-N 3.32Å; T248-F250 PolarHBondContact O-N 3.46Å; T248-S251 CarbonylContact O-C 3.59Å; T248-S251 PolarHBondContact O-N 2.98Å; T248-S251 VanDerWaalsContact O-N 3.09Å; T248-T252 WeakPolarHBondContact O-CG2 3.36Å; T248-T252 PolarHBondContact O-N 3.44Å; T248-T252 PolarHBondContact O-OG1 3.08Å; T248-T252 VanDerWaalsContact O-OG1 3.09Å
249H51.5Low52.3Low121 Ų121125 Ų12556%0.5663%0.634SS**Hα-helixtrans-59.5-38.9172.3-76.5-62.8000112.9Q245 T252 A253Q245-H249 WeakPolarHBondContact O-CB 3.41Å; Q245-H249 PolarHBondContact O-CD2 3.35Å; Q245-H249 PolarHBondContact O-N 3.21Å; H249-T252 WeakPolarHBondContact CA-OG1 3.32Å; H249-T252 PolarHBondContact O-OG1 3.23Å; H249-T252 VanDerWaalsContact O-OG1 3.06Å; H249-A253 WeakPolarHBondContact O-CB 3.16Å; H249-A253 PolarHBondContact O-N 3.34Å
250F51.8Low51Low137 Ų137122.2 Ų122.260%0.60164%0.638SS**Hα-helixtrans-73.8-29.3175.3-151.1-101.8000112.5V246 T248 Y254V246-F250 PolarHBondContact O-N 3.45Å; T248-F250 VanDerWaalsContact C-N 3.32Å; T248-F250 PolarHBondContact O-N 3.46Å; F250-Y254 AromaticContact CD1-CE2 3.74Å; F250-Y254 HydrophobicContact CD1-CE2 3.74Å; F250-Y254 AromaticContact CE1-CE2 3.47Å; F250-Y254 HydrophobicContact CE1-CE2 3.47Å; F250-Y254 VanDerWaalsContact CE1-CE2 3.47Å; F250-Y254 AromaticContact CE1-CZ 3.95Å; F250-Y254 HydrophobicContact CZ-CE2 4.13Å; F250-Y254 WeakPolarHBondContact O-CD2 3.42Å
251S52.2Low49.9Very low83 Ų83129.1 Ų129.158%0.5866%0.661SS**Hα-helixtrans-76.3-33.3175.3-155.90000112.7R247 T248R247-S251 PolarHBondContact O-N 3.03Å; T248-S251 CarbonylContact O-C 3.59Å; T248-S251 PolarHBondContact O-N 2.98Å; T248-S251 VanDerWaalsContact O-N 3.09Å
252T53.4Low49.1Very low84 Ų84131.7 Ų131.752%0.51567%0.669SS.*Hα-helixtrans-77.3-23.6173.956.40000112.3T248 H249 Y254 E255T248-T252 WeakPolarHBondContact O-CG2 3.36Å; T248-T252 PolarHBondContact O-N 3.44Å; T248-T252 PolarHBondContact O-OG1 3.08Å; T248-T252 VanDerWaalsContact O-OG1 3.09Å; H249-T252 WeakPolarHBondContact CA-OG1 3.32Å; H249-T252 PolarHBondContact O-OG1 3.23Å; H249-T252 VanDerWaalsContact O-OG1 3.06Å; T252-Y254 PolarHBondContact O-N 3.1Å; T252-E255 PolarHBondContact O-N 3.05Å; T252-E255 VanDerWaalsContact O-N 3.11Å
253A54.6Low48.1Very low69 Ų69132.5 Ų132.557%0.5767%0.672SS**THydrogen-bonded Turntrans-68-16.1175.300000113.4H249H249-A253 WeakPolarHBondContact O-CB 3.16Å; H249-A253 PolarHBondContact O-N 3.34Å
254Y49.6Very low47.2Very low171 Ų171133 Ų13367%0.67168%0.678SS**THydrogen-bonded Turntrans-98-5170.3-65.1-71.6000114F250 T252 L256F250-Y254 AromaticContact CD1-CE2 3.74Å; F250-Y254 HydrophobicContact CD1-CE2 3.74Å; F250-Y254 AromaticContact CE1-CE2 3.47Å; F250-Y254 HydrophobicContact CE1-CE2 3.47Å; F250-Y254 VanDerWaalsContact CE1-CE2 3.47Å; F250-Y254 AromaticContact CE1-CZ 3.95Å; F250-Y254 HydrophobicContact CZ-CE2 4.13Å; F250-Y254 WeakPolarHBondContact O-CD2 3.42Å; T252-Y254 PolarHBondContact O-N 3.1Å; Y254-L256 VanDerWaalsContact C-N 3.29Å; Y254-L256 PolarHBondContact O-N 3.43Å
255E45.5Very low46.4Very low164 Ų164137.3 Ų137.377%0.76669%0.69SS**  trans-86.980.2160.2-75.4-134.4150.100108.5T252 P257T252-E255 PolarHBondContact O-N 3.05Å; T252-E255 VanDerWaalsContact O-N 3.11Å; E255-P257 WeakPolarHBondContact O-CD 3.43Å
256L43.7Very low45.8Very low141 Ų141134.6 Ų134.674%0.73869%0.689SS**  trans-48.6124.5155.4-87.1148.5000108.3Y254 L258Y254-L256 VanDerWaalsContact C-N 3.29Å; Y254-L256 PolarHBondContact O-N 3.43Å; L256-L258 PolarHBondContact O-N 3.39Å
257P46Very low45.1Very low113 Ų113138 Ų13873%0.73470%0.699SS**  trans-64.589.5165.7-19.132.5000108.6E255 L259E255-P257 WeakPolarHBondContact O-CD 3.43Å; P257-L259 PolarHBondContact O-N 3.07Å
258L44.6Very low44.8Very low161 Ų161136.5 Ų136.584%0.84370%0.703SS**  trans-69.181.9160.7-69.4179.6000106.8L256 T260L256-L258 PolarHBondContact O-N 3.39Å; L258-T260 PolarHBondContact O-N 3.15Å
259L43.4Very low44Very low148 Ų148141.7 Ų141.778%0.77572%0.723SS**  trans-54.7132.3165-89.9160.9000109.1P257P257-L259 PolarHBondContact O-N 3.07Å
260T40.3Very low43.4Very low134 Ų134142.7 Ų142.782%0.82273%0.732SS**  trans82.888.2162.372.20000118.5L258L258-T260 PolarHBondContact O-N 3.15Å
261R36.1Very low43.1Very low239 Ų239141.4 Ų141.490%0.90274%0.737SS**  trans-143.2119.4133.3-167.7175.8167.3154.4-2.3109.9
262P43Very low42.3Very low105 Ų105142.4 Ų142.468%0.68274%0.744SS**  trans-83.7147.818035.7-32.6000110.5
263E36.1Very low42.2Very low177 Ų177148.2 Ų148.283%0.82776%0.757SS**  trans79.8123.3150.6-52.4-98.2157.300119.1
264N35Very low41.7Very low131 Ų131152.4 Ų152.470%0.70177%0.768SS**  trans102.1110.7146-125.6-84.1000119.9
265Y35.4Very low41Very low210 Ų210148 Ų14882%0.82478%0.775SS**  trans68.1133.5147.1-114.7-111.1000118.1
266A38.9Very low40.6Very low67 Ų67143.6 Ų143.655%0.55477%0.773SS**  cis-167.8150.4-1.100000109.7
267Q41.2Very low40.3Very low172 Ų172142.4 Ų142.480%0.80478%0.777SS**  trans53103.7135.6-150.2166.5-4600118.9Q269Q267-Q269 PolarHBondContact O-N 2.73Å
268I44.8Very low40.1Very low164 Ų164142.8 Ų142.884%0.84178%0.782SS**  trans-59127.4163.7-61.1166.1000110
269Q37.2Very low39.8Very low185 Ų185140 Ų14086%0.86478%0.782SS**  trans-132.8134.2145.7-109.8-177.4-4.400110.7Q267Q267-Q269 PolarHBondContact O-N 2.73Å
270N38.1Very low39.6Very low142 Ų142137.8 Ų137.876%0.75979%0.785SS**  trans-57.2154-172.3-130.8-46.2000113.7S272N270-S272 PolarHBondContact O-N 2.92Å
271P46.4Very low39.5Very low109 Ų109136.4 Ų136.471%0.70878%0.781SS**  trans-74.9112.2-177.3-6.723.9000111.8
272S34.7Very low39.8Very low104 Ų104130.5 Ų130.573%0.72777%0.774SS**  trans-90.2104.3161.8-58.90000108.5N270N270-S272 PolarHBondContact O-N 2.92Å
273W51.3Low40Very low206 Ų206131.2 Ų131.278%0.7878%0.776SS**  trans-26.1128.8151.431.2-82.6000113.5
274I45.3Very low40.4Very low158 Ų158128.2 Ų128.281%0.8177%0.772SS**  trans109.9124.4154.9-55.1168.7000117.8
275G33.7Very low41Very low78 Ų78125.3 Ų125.380%0.80477%0.773SS**  trans94.8121.8150.200000114.6
276G37.4Very low41.2Very low72 Ų72120.7 Ų120.774%0.74277%0.77SS**  cis117.899.423.700000108.9
277S37.7Very low41.8Very low116 Ų116124.5 Ų124.581%0.81179%0.786SS**  trans139.7113.9151.8-61.60000114.4
278S42.1Very low42.1Very low121 Ų121122.1 Ų122.185%0.84678%0.783SS**  trans39.9106.6141.3170000120.6
279A38Very low42.3Very low101 Ų101119.1 Ų119.184%0.83577%0.774SS**  trans-165.9123.3134.700000111.1
280A39.9Very low42.4Very low103 Ų103116.3 Ų116.385%0.85177%0.774SS**  trans13.7110159.300000119
281S36.3Very low42.3Very low104 Ų104116.3 Ų116.373%0.72777%0.774SS**  trans-93.6120.4157.9-178.40000109.1
282P43.8Very low42.4Very low115 Ų115117 Ų11775%0.74778%0.776SS**  trans-84.9110.2160.831.9-24.3000107.2P284P282-P284 WeakPolarHBondContact O-CD 3.4Å
283V46.7Very low42.8Very low121 Ų121118.8 Ų118.873%0.73378%0.782SS**  trans-80.1127.4166.8-172.40000107.5
284P44.9Very low42.3Very low113 Ų113115.1 Ų115.173%0.73478%0.782SS**  trans-95.4111.7146.930.9-20.7000107.4P282 C286P282-P284 WeakPolarHBondContact O-CD 3.4Å; P284-C286 PolarHBondContact O-N 3.17Å
285G46.2Very low41.9Very low70 Ų70113.2 Ų113.272%0.72278%0.779SS**  trans-63.7122.616900000109.4
286C40.3Very low42.2Very low113 Ų113114.8 Ų114.876%0.76478%0.776SS**  trans-109.895.7164.433.10000108.2P284 V288P284-C286 PolarHBondContact O-N 3.17Å; C286-V288 PolarHBondContact O-N 3.37Å
287V51.8Low43Very low147 Ų147119.2 Ų119.289%0.89178%0.779SS**  trans-55.5122.5154.4-136.50000106.7
288V48.3Very low43.2Very low123 Ų123120.3 Ų120.375%0.74578%0.781SS**  trans-105.4126.8172.1-171.20000108.4C286C286-V288 PolarHBondContact O-N 3.37Å
289P47.4Very low44Very low100 Ų100119.3 Ų119.365%0.64977%0.772SS**  trans-64.4134172-15.929.6000110.8D291P289-D291 PolarHBondContact O-N 3.14Å
290C40.4Very low44Very low127 Ų127123.4 Ų123.486%0.85877%0.773SS**  trans-77.599.6167.3-178.50000108.1
291D35.5Very low44.5Very low142 Ų142122.8 Ų122.876%0.75976%0.76SS**  trans-81.8131166.2-82.5-54.1000111P289P289-D291 PolarHBondContact O-N 3.14Å
292T49.4Very low44.8Very low123 Ų123127.1 Ų127.176%0.75577%0.769SS**  trans-53.2123.2178.3-48.80000112.1
293V42.8Very low44.3Very low141 Ų141127.2 Ų127.286%0.85577%0.772SS**  trans-129.9134.8155.9-66.70000111.9
294T39.8Very low43.9Very low129 Ų129125.8 Ų125.879%0.79177%0.773SS**  trans-78.3135-162.2-550000113.1C296T294-C296 PolarHBondContact O-N 3.45Å
295T37.8Very low43.4Very low119 Ų119126.5 Ų126.573%0.7378%0.781SS**  trans-45.2121.1162.8-56.50000112.9M297T295-M297 HydrophobicContact CG2-CB 4.29Å; T295-M297 PolarHBondContact O-N 3.46Å
296C40.6Very low42.8Very low110 Ų110126.1 Ų126.174%0.74378%0.777SS**  trans-93.175.4165.3550000110.3T294T294-C296 PolarHBondContact O-N 3.45Å
297M52.8Low42.7Very low166 Ų166127.7 Ų127.782%0.81878%0.783SS**  trans-140.3114.1158.8-73.8-69.7121.300107.1T295T295-M297 HydrophobicContact CG2-CB 4.29Å; T295-M297 PolarHBondContact O-N 3.46Å
298T43.5Very low42.1Very low139 Ų139125.5 Ų125.585%0.85377%0.774SS**  trans-106.2146.8179.2-34.70000108.3
299P57.9Low41.5Very low100 Ų100126.3 Ų126.365%0.64977%0.774SS**  trans-104.7175.7-143.740-33.2000112.5
300H39Very low41.2Very low187 Ų187130.2 Ų130.287%0.86678%0.781SS**  trans-158.8155.4131.5-107.270.6000111.5
301P48.6Very low41.1Very low89 Ų89131.5 Ų131.558%0.57878%0.779SS**  trans-104.5159.7-14839.3-33.3000112.6
302H42.5Very low41.4Very low195 Ų195128.1 Ų128.190%0.90378%0.777SS**  trans-152.3151.8138.6-78.8-58.1000110.8
303S34.5Very low40.8Very low117 Ų117129.2 Ų129.282%0.81878%0.783SS**  trans-86.4167-152.342.80000115.7
304A37.5Very low40.6Very low91 Ų91127.9 Ų127.975%0.75278%0.781SS**  trans-68.1174.5-176.100000117.2
305S34.3Very low40.4Very low129 Ų129127.3 Ų127.390%0.90278%0.782SS**  trans89.5133.8171.7-52.50000114.1
306G33.6Very low40.9Very low62 Ų62127.3 Ų127.364%0.63978%0.784SS**  cis171159.9500000108.7
307V37.8Very low40.5Very low145 Ų145125.9 Ų125.988%0.87979%0.788SS**  trans56.4121.8153-55.60000122
308S40.3Very low39.6Very low102 Ų102121.9 Ų121.971%0.71379%0.789SS**  49.6128.6128.9-90.10000124.6
309D35.5Very low39.4Very low140 Ų140124 Ų12475%0.74979%0.788SS**  trans80.5122.2131.3-67.8-58.2000122.6
310F41.1Very low38.6Very low181 Ų181127.8 Ų127.879%0.79480%0.802SS**  trans59.5118.8132.4-152.8-104.2000119.3
311L38.7Very low38.3Very low155 Ų155122.5 Ų122.581%0.81280%0.797SS**  179.5130.4119-90.3168.8000109.9
312G40.8Very low38Very low70 Ų70125.5 Ų125.572%0.72280%0.804SS**  trans-76.5160.5176.300000113.7
313V38Very low38.1Very low146 Ų146121.8 Ų121.889%0.88580%0.797SS**  trans-154.3128.6151.265.40000109.7
314S38.7Very low38.4Very low114 Ų114122.8 Ų122.880%0.79779%0.788SS**  trans-81.9146.4176-51.50000111.4
315S34.6Very low38.6Very low116 Ų116127.3 Ų127.381%0.81180%0.796SS**  trans-165.3160.3159.8-127.60000111.2
316P48.1Very low38.5Very low119 Ų119123.9 Ų123.977%0.77378%0.781SS**  -121.4168-89.529.6-12.3000113.1
317G33.3Very low38.6Very low81 Ų81127 Ų12784%0.83579%0.793SS**  trans-70.8159.8178.700000115
318G32.8Very low38.7Very low81 Ų81127.8 Ų127.884%0.83579%0.792SS**  trans-170.174.1166.900000109.8
319H39.7Very low38.6Very low183 Ų183132.9 Ų132.985%0.84780%0.801SS**  trans-125.7110.916265.8-85.7000108.3
320I40.9Very low38.4Very low181 Ų181130 Ų13093%0.92881%0.805SS**  trans-123.3136.3173.4-127154.8000106.5
321G33.5Very low38Very low75 Ų75125.4 Ų125.477%0.77381%0.808SS**  trans99.678.4162.400000116.6
322Q42.4Very low37.7Very low152 Ų152123.6 Ų123.671%0.7181%0.809SS**  trans-70149.4139.8-107.1-85.5-56.200108.1
323P44.6Very low38.2Very low117 Ų117125.8 Ų125.876%0.7681%0.81SS**  -141.714188.933.9-17.5000114.9
324H40.1Very low38Very low138 Ų138121.8 Ų121.864%0.63980%0.799SS**  trans-72.5140.2160.498.7-70.6000110.1
325M41.1Very low38Very low187 Ų187124.9 Ų124.992%0.92180%0.803SS**  trans-129.4134.5149.9-50.8-15884.600104
326G33.6Very low38Very low57 Ų57123.9 Ų123.959%0.58880%0.802SS**  cis172.1106.50.100000103.2
327S34Very low37.6Very low127 Ų127123.5 Ų123.589%0.88881%0.808SS**  trans-97.2108.2166-1040000106.8
328L40.9Very low37.5Very low162 Ų162122.7 Ų122.785%0.84880%0.8SS**  trans-75.4155.3174.3-79.3154.1000110.8
329F39.2Very low38Very low208 Ų208126.3 Ų126.391%0.91280%0.799SS**  trans79.2105.4-171.1-77.8-91.7000114.2
330G31Very low37.9Very low80 Ų80124.6 Ų124.683%0.82580%0.796SS**  cis119.499.721.600000108.2
331G31.3Very low38.2Very low84 Ų84122.5 Ų122.587%0.86679%0.792SS**  trans164.778.7177.800000112.9
332S33.1Very low38.7Very low118 Ų118128 Ų12883%0.82579%0.791SS**  trans-99.8175.9161.2-115.30000108.5
333P51.3Low38.5Very low116 Ų116127.7 Ų127.775%0.75379%0.794SS**  cis-141.4175.3-15.731.7-10.3000114.8
334G33.2Very low38.3Very low62 Ų62129.6 Ų129.664%0.63980%0.796SS**  trans100.5140.1149.600000115.6
335M39.3Very low38.5Very low179 Ų179129.8 Ų129.888%0.88280%0.802SS**  cis-156.5151.110.2-69.4-64.4179.100109.9
336A35.6Very low38.8Very low95 Ų95128.6 Ų128.679%0.78580%0.796SS**  trans48.4115.214100000122.1
337A38.4Very low39.1Very low110 Ų110131.8 Ų131.891%0.90980%0.8SS**  47.3125.5124.500000120.7
338G31.4Very low40Very low65 Ų65130.1 Ų130.167%0.6779%0.786SS**  trans153.399.7150.500000114.4
339I44.3Very low40.5Very low157 Ų157128.1 Ų128.181%0.80578%0.776SS**  trans19.1116.3135.942.9166.1000117.3
340N37Very low41.1Very low147 Ų147128.7 Ų128.779%0.78677%0.772SS**  -170.3128126.3-88.5-39.5000112.9
341T46.6Very low42.2Very low137 Ų137134.3 Ų134.384%0.8477%0.774SS**  trans-76.1107.6170.4-73.10000110.6
342Y45.4Very low43.3Very low191 Ų191133.7 Ų133.775%0.74976%0.756SS**  trans169126.6149.461.7-91.1000105.4
343D36.3Very low44.6Very low145 Ų145132.7 Ų132.778%0.77575%0.75SS**  -171134.376.6-156.6-94.1000109.2N345D343-N345 PolarHBondContact O-N 3.34Å
344L41.8Very low46Very low156 Ų156130.3 Ų130.382%0.81774%0.735SS**  trans-74.4105.2178.1-75.1163.3000110M346L344-M346 PolarHBondContact O-N 3.29Å
345N44Very low48.2Very low143 Ų143132.9 Ų132.977%0.76573%0.734SS**  26.983.2125.4-165.72.3000115.5D343D343-N345 PolarHBondContact O-N 3.34Å
346M47.5Very low50.1Low162 Ų162127 Ų12780%0.79871%0.713SS**  trans-12155.9168.1-124.8-75.19900109.8L344 P348L344-M346 PolarHBondContact O-N 3.29Å; M346-P348 VanDerWaalsContact O-CD 3.31Å; M346-P348 WeakPolarHBondContact O-CD 3.3Å
347D39.5Very low52.5Low124 Ų124124.5 Ų124.566%0.66369%0.693SS**  trans-99.9101.9168.2-103.3-63.3000109.6D349D347-D349 PolarHBondContact O-N 3.42Å
348P53.8Low54.8Low92 Ų92124.3 Ų124.360%0.59768%0.676SS**  trans-70.5116.1177.527.9-30.9000110M346 R350M346-P348 VanDerWaalsContact O-CD 3.31Å; M346-P348 WeakPolarHBondContact O-CD 3.3Å; P348-R350 PolarHBondContact O-N 3.42Å; P348-R350 VanDerWaalsContact O-N 3.11Å
349D50.1Low57.5Low120 Ų120129.8 Ų129.864%0.64268%0.676SS**  trans54.839.3141.6-100.5-63.4000119.7D347 K351 S352D347-D349 PolarHBondContact O-N 3.42Å; D349-K351 PolarHBondContact O-N 3.32Å; D349-K351 VanDerWaalsContact O-N 3.12Å; D349-S352 WeakPolarHBondContact OD1-CB 3.48Å; D349-S352 PolarHBondContact OD1-OG 3.17Å
350R52.6Low59.4Low219 Ų219128.4 Ų128.483%0.82667%0.668SS**THydrogen-bonded Turntrans-67.4-5.4164.2-67.3-172.4-177-125.51.5113.9P348P348-R350 PolarHBondContact O-N 3.42Å; P348-R350 VanDerWaalsContact O-N 3.11Å
351K52.9Low61.7Low199 Ų199127.2 Ų127.287%0.86566%0.656SS**THydrogen-bonded Turntrans-101.2-11.2-171.4-59.1166.5-175.8173.40114.2D349 S353D349-K351 PolarHBondContact O-N 3.32Å; D349-K351 VanDerWaalsContact O-N 3.12Å; K351-S353 VanDerWaalsContact C-N 3.26Å; K351-S353 PolarHBondContact O-N 3Å
352S55.2Low63.3Low70 Ų70123.6 Ų123.649%0.4964%0.64SS.*  trans-87.427.3-179.3-70.40000114.6D349 S354D349-S352 WeakPolarHBondContact OD1-CB 3.48Å; D349-S352 PolarHBondContact OD1-OG 3.17Å; S352-S354 PolarHBondContact O-N 3.34Å
353S61.5Low64.9Low98 Ų98121.8 Ų121.869%0.68564%0.636SS**  trans-80.132.2175.9-57.90000113K351K351-S353 VanDerWaalsContact C-N 3.26Å; K351-S353 PolarHBondContact O-N 3Å
354S80.4Confident66.7Low65 Ų65121 Ų12146%0.45563%0.627SS.*  trans-73.5136.8174.5177.30000109.5S352 A356 A357 L358S352-S354 PolarHBondContact O-N 3.34Å; S354-A356 PolarHBondContact O-N 3.17Å; S354-A356 PolarHBondContact OG-N 3.39Å; S354-A357 WeakPolarHBondContact O-CB 3.47Å; S354-A357 PolarHBondContact O-N 2.81Å; S354-L358 PolarHBondContact O-N 3.36Å
355I79.1Confident68Low117 Ų117118.8 Ų118.860%0.661%0.613SS**Hα-helixtrans-54-29.3175-149.592.7000111.1R359I355-R359 WeakPolarHBondContact O-CB 3.24Å; I355-R359 WeakPolarHBondContact O-CD 3.32Å; I355-R359 WeakPolarHBondContact O-CG 3.37Å; I355-R359 PolarHBondContact O-N 3.48Å; I355-R359 VanDerWaalsContact O-N 3.1Å
356A79.1Confident69Low54 Ų54115.5 Ų115.545%0.44660%0.601SS.*Hα-helixtrans-70.1-46.2176.200000111.7S354 L358 R359 M360S354-A356 PolarHBondContact O-N 3.17Å; S354-A356 PolarHBondContact OG-N 3.39Å; A356-L358 VanDerWaalsContact C-N 3.34Å; A356-L358 PolarHBondContact O-N 3.37Å; A356-R359 PolarHBondContact O-N 3.37Å; A356-M360 VanDerWaalsContact O-CG 3.32Å; A356-M360 WeakPolarHBondContact O-CG 3.46Å; A356-M360 PolarHBondContact O-N 3.28Å
357A86.4Confident69.8Low44 Ų44110.3 Ų110.336%0.36458%0.583SS.*Hα-helixtrans-61.9-41.9176.900000111.6S354 R359 M360 K361S354-A357 WeakPolarHBondContact O-CB 3.47Å; S354-A357 PolarHBondContact O-N 2.81Å; A357-R359 PolarHBondContact O-N 3.25Å; A357-M360 PolarHBondContact O-N 2.81Å; A357-K361 WeakPolarHBondContact O-CB 3.41Å; A357-K361 PolarHBondContact O-N 2.59Å
358L86.7Confident70.9Confident106 Ų106106.1 Ų106.156%0.55557%0.566SS**Hα-helixtrans-63.4-39175.4-68.2174.1000112.6S354 A356 A362S354-L358 PolarHBondContact O-N 3.36Å; A356-L358 VanDerWaalsContact C-N 3.34Å; A356-L358 PolarHBondContact O-N 3.37Å; L358-A362 WeakPolarHBondContact O-CB 3.45Å; L358-A362 PolarHBondContact O-N 2.88Å
359R86.5Confident71.5Confident180 Ų180107.9 Ų107.968%0.67957%0.569SS**Hα-helixtrans-68.1-41.1176.5-76.8170178.6-170.9-0.1112.3I355 A356 A357 K363I355-R359 WeakPolarHBondContact O-CB 3.24Å; I355-R359 WeakPolarHBondContact O-CD 3.32Å; I355-R359 WeakPolarHBondContact O-CG 3.37Å; I355-R359 PolarHBondContact O-N 3.48Å; I355-R359 VanDerWaalsContact O-N 3.1Å; A356-R359 PolarHBondContact O-N 3.37Å; A357-R359 PolarHBondContact O-N 3.25Å; R359-K363 PolarHBondContact O-N 2.79Å
360M85.4Confident71.9Confident127 Ų127106.4 Ų106.463%0.62657%0.568SS**Hα-helixtrans-64.8-46.8176.5-67.2-65.3-109.200110.7A356 A357 A362 K363 E364A356-M360 VanDerWaalsContact O-CG 3.32Å; A356-M360 WeakPolarHBondContact O-CG 3.46Å; A356-M360 PolarHBondContact O-N 3.28Å; A357-M360 PolarHBondContact O-N 2.81Å; M360-A362 VanDerWaalsContact C-N 3.34Å; M360-A362 PolarHBondContact O-N 3.06Å; M360-K363 WeakPolarHBondContact O-CB 3.41Å; M360-K363 PolarHBondContact O-N 2.81Å; M360-K363 VanDerWaalsContact O-N 3.08Å; M360-E364 PolarHBondContact O-N 3.17Å
361K85.6Confident71.8Confident122 Ų122105.3 Ų105.353%0.5356%0.564SS.*Hα-helixtrans-61.4-38.8177.6-171.6162.1-175.2166.20113A357 K363 E364 H365A357-K361 WeakPolarHBondContact O-CB 3.41Å; A357-K361 PolarHBondContact O-N 2.59Å; K361-K363 VanDerWaalsContact C-N 3.3Å; K361-K363 PolarHBondContact O-N 3.09Å; K361-E364 PolarHBondContact O-N 3.18Å; K361-H365 PolarHBondContact O-CD2 3.47Å; K361-H365 PolarHBondContact O-N 3.23Å
362A79.6Confident71.8Confident61 Ų6199.4 Ų99.450%0.50455%0.552SS.*Hα-helixtrans-63.1-37.517500000112.4L358 M360 H365 S366L358-A362 WeakPolarHBondContact O-CB 3.45Å; L358-A362 PolarHBondContact O-N 2.88Å; M360-A362 VanDerWaalsContact C-N 3.34Å; M360-A362 PolarHBondContact O-N 3.06Å; A362-H365 PolarHBondContact O-N 3.09Å; A362-S366 PolarHBondContact O-N 3.37Å; A362-S366 PolarHBondContact O-OG 3.05Å
363K79.6Confident71.3Confident153 Ų153105.1 Ų105.167%0.66559%0.585SS**Hα-helixtrans-68.8-36.7178.2-164.1176.3167.6-168.20111.7R359 M360 K361 S366 A367R359-K363 PolarHBondContact O-N 2.79Å; M360-K363 WeakPolarHBondContact O-CB 3.41Å; M360-K363 PolarHBondContact O-N 2.81Å; M360-K363 VanDerWaalsContact O-N 3.08Å; K361-K363 VanDerWaalsContact C-N 3.3Å; K361-K363 PolarHBondContact O-N 3.09Å; K363-S366 VanDerWaalsContact C-OG 3.31Å; K363-S366 VanDerWaalsContact CA-OG 3.3Å; K363-S366 WeakPolarHBondContact CA-OG 3.4Å; K363-S366 PolarHBondContact O-N 3.47Å; K363-S366 PolarHBondContact O-OG 3.34Å; K363-A367 PolarHBondContact O-N 3.11Å; K363-A367 VanDerWaalsContact O-N 3.14Å
364E72.4Confident71.8Confident129 Ų129105.5 Ų105.560%0.60358%0.58SS**Hα-helixtrans-65.1-44.5171.8-69.7169.8-179.700111.8M360 K361 S366 A367 A368M360-E364 PolarHBondContact O-N 3.17Å; K361-E364 PolarHBondContact O-N 3.18Å; E364-S366 VanDerWaalsContact C-N 3.31Å; E364-S366 PolarHBondContact O-N 3.29Å; E364-A367 PolarHBondContact O-N 3.23Å; E364-A368 WeakPolarHBondContact O-CB 3.33Å; E364-A368 PolarHBondContact O-N 2.79Å
365H71Confident71.3Confident110 Ų110107.6 Ų107.651%0.50959%0.586SS.*Hα-helixtrans-60.8-37.2175.5-83.3-74000112.8K361 A362 A368 I369K361-H365 PolarHBondContact O-CD2 3.47Å; K361-H365 PolarHBondContact O-N 3.23Å; A362-H365 PolarHBondContact O-N 3.09Å; H365-A368 PolarHBondContact O-N 2.92Å; H365-I369 WeakPolarHBondContact O-CD1 3.21Å; H365-I369 WeakPolarHBondContact O-CG1 3.36Å; H365-I369 PolarHBondContact O-N 3.4Å
366S65.1Low70.9Confident73 Ų73107.1 Ų107.151%0.5159%0.586SS.*Hα-helixtrans-67.7-38174.341.80000113.2A362 K363 E364 A368 S370A362-S366 PolarHBondContact O-N 3.37Å; A362-S366 PolarHBondContact O-OG 3.05Å; K363-S366 VanDerWaalsContact C-OG 3.31Å; K363-S366 VanDerWaalsContact CA-OG 3.3Å; K363-S366 WeakPolarHBondContact CA-OG 3.4Å; K363-S366 PolarHBondContact O-N 3.47Å; K363-S366 PolarHBondContact O-OG 3.34Å; E364-S366 VanDerWaalsContact C-N 3.31Å; E364-S366 PolarHBondContact O-N 3.29Å; S366-A368 VanDerWaalsContact C-N 3.25Å; S366-A368 PolarHBondContact O-N 3.23Å; S366-S370 PolarHBondContact O-OG 3.44Å
367A64.1Low70.4Confident53 Ų53110.2 Ų110.244%0.43859%0.594SS.*Hα-helixtrans-68.7-28.7175.100000111.8K363 E364 I369 S370K363-A367 PolarHBondContact O-N 3.11Å; K363-A367 VanDerWaalsContact O-N 3.14Å; E364-A367 PolarHBondContact O-N 3.23Å; A367-I369 VanDerWaalsContact C-N 3.34Å; A367-S370 WeakPolarHBondContact CA-OG 3.4Å; A367-S370 PolarHBondContact O-OG 3.45Å
368A62.2Low69.4Low36 Ų36114.4 Ų114.430%0.29861%0.608SS.*Hα-helixtrans-68.8-31.8179.800000113.8E364 H365 S366 W371E364-A368 WeakPolarHBondContact O-CB 3.33Å; E364-A368 PolarHBondContact O-N 2.79Å; H365-A368 PolarHBondContact O-N 2.92Å; S366-A368 VanDerWaalsContact C-N 3.25Å; S366-A368 PolarHBondContact O-N 3.23Å; A368-W371 HydrophobicContact CB-CZ2 4.29Å; A368-W371 WeakPolarHBondContact O-CZ2 3.33Å; A368-W371 PolarHBondContact O-NE1 2.83Å
369I65.5Low68.3Low129 Ų129114.9 Ų114.966%0.66261%0.612SS**Hα-helixtrans-82-26.9-177.8-65.1161.5000110.9H365 A367 W371 A372H365-I369 WeakPolarHBondContact O-CD1 3.21Å; H365-I369 WeakPolarHBondContact O-CG1 3.36Å; H365-I369 PolarHBondContact O-N 3.4Å; A367-I369 VanDerWaalsContact C-N 3.34Å; I369-W371 VanDerWaalsContact C-N 3.31Å; I369-W371 PolarHBondContact O-N 2.84Å; I369-A372 PolarHBondContact O-N 3.22Å
370S58.7Low67Low89 Ų89110.3 Ų110.362%0.62261%0.607SS**THydrogen-bonded Turntrans-74.3-9.4-178.6400000115.7S366 A367S366-S370 PolarHBondContact O-OG 3.44Å; A367-S370 WeakPolarHBondContact CA-OG 3.4Å; A367-S370 PolarHBondContact O-OG 3.45Å
371W50.9Low65.5Low197 Ų197109 Ų10975%0.74661%0.605SS**THydrogen-bonded Turntrans-102.31175.854.6-109000114.4A368 I369A368-W371 HydrophobicContact CB-CZ2 4.29Å; A368-W371 WeakPolarHBondContact O-CZ2 3.33Å; A368-W371 PolarHBondContact O-NE1 2.83Å; I369-W371 VanDerWaalsContact C-N 3.31Å; I369-W371 PolarHBondContact O-N 2.84Å
372A51.7Low63.9Low74 Ų74107.9 Ų107.961%0.61261%0.612SS**  trans-101.218.9-179.300000113.7I369I369-A372 PolarHBondContact O-N 3.22Å
373T45.6Very low62.4Low191 Ų191112.2 Ų112.2100%1.17262%0.622SS**  trans-1320168.6-74.10000107.6

Retrieved 373 of 373 residues in 299.4 ms (Link to these results)